Resolution: 300 SA_size: 7 13 Num_Atom: 5 Key_Num: 121 GenSubs_Ids: -1 -1 -1 [6,0,0,0,0,4],1,3,[1,0,-1,0,1],[1,0,-1,0,3],[1,5,-1,0,4],(543,63) [6,0,0,0,0,4],2,2,[1,0,-1,0,0],[1,0,-1,0,2],(553,62) [6,0,0,0,0,4],3,1,[1,0,-1,0,1],(554,79) [6,0,0,0,0,4],3,1,[1,0,-1,0,0],(543,79) [6,0,0,0,0,4],3,1,[1,6,-1,0,0],(522,64) reaction_nb: 0 Num_Atom: 13 Key_Num: 0 GenSubs_Ids: -1 -1 -1 [8,0,0,0,0,2],0,1,[2,0,-1,0,9],(1593,205) [1122,0,0,0,0,1],0,1,[1,0,-1,0,2],(1627,505) [6,0,0,0,0,4],2,2,[1,0,-1,0,1],[1,0,-1,0,3],(1594,458) [6,0,0,0,0,4],2,2,[1,0,-1,0,2],[1,0,-1,0,4],(1625,413) [6,0,0,0,0,4],0,4,[1,0,-1,0,3],[1,0,-1,0,5],[1,0,-1,0,6],[1,0,-1,0,12],(1593,370) [6,0,0,0,0,4],3,1,[1,0,-1,0,4],(1565,418) [6,0,0,0,0,4],1,2,[1,0,-1,0,4],[2,1,-1,0,7],(1545,343) [6,0,0,0,0,4],0,3,[2,1,-1,0,6],[1,0,-1,0,8],[1,0,-1,0,9],(1545,287) [6,0,0,0,0,4],3,1,[1,0,-1,0,7],(1496,261) [6,0,0,0,0,4],0,3,[1,0,-1,0,7],[2,0,-1,0,0],[1,0,-1,0,10],(1595,261) [6,0,0,0,0,4],0,3,[1,0,-1,0,9],[1,0,-1,0,11],[2,1,-1,0,12],(1641,288) [6,0,0,0,0,4],3,1,[1,0,-1,0,10],(1689,262) [6,0,0,0,0,4],1,2,[2,1,-1,0,10],[1,0,-1,0,4],(1640,345) reaction_nb: 0 Num_Atom: 10 Key_Num: -1 GenSubs_Ids: -1 -1 -1 [1180,0,0,0,0,1],0,1,[1,0,-1,0,6],(113,188) [6,0,0,0,0,4],3,1,[1,0,-1,0,2],(113,408) [6,0,0,0,0,4],0,3,[1,0,-1,0,1],[2,1,-1,0,3],[1,0,-1,0,9],(113,353) [6,0,0,0,0,4],1,2,[2,1,-1,0,2],[1,0,-1,0,4],(68,325) [6,0,0,0,0,4],0,3,[1,0,-1,0,3],[1,0,-1,0,5],[2,1,-1,0,6],(68,268) [6,0,0,0,0,4],3,1,[1,0,-1,0,4],(29,241) [6,0,0,0,0,4],0,3,[2,1,-1,0,4],[1,0,-1,0,0],[1,0,-1,0,7],(113,244) [6,0,0,0,0,4],0,3,[1,0,-1,0,6],[1,0,-1,0,8],[2,1,-1,0,9],(160,271) [6,0,0,0,0,4],3,1,[1,0,-1,0,7],(207,246) [6,0,0,0,0,4],1,2,[2,1,-1,0,7],[1,0,-1,0,2],(160,328) reaction_nb: 0 Num_Atom: 13 Key_Num: -1 GenSubs_Ids: -1 -1 -1 [8,0,0,0,0,2],0,1,[2,0,-1,0,9],(774,197) [6,0,0,0,0,4],2,1,[2,0,-1,0,2],(809,495) [6,0,0,0,0,4],1,2,[2,0,-1,0,1],[1,0,-1,0,3],(777,451) [6,0,0,0,0,4],2,2,[1,0,-1,0,2],[1,0,-1,0,4],(808,407) [6,0,0,0,0,4],0,4,[1,0,-1,0,3],[1,0,-1,0,5],[1,0,-1,0,6],[1,0,-1,0,12],(776,362) [6,0,0,0,0,4],3,1,[1,0,-1,0,4],(747,410) [6,0,0,0,0,4],1,2,[1,0,-1,0,4],[2,1,-1,0,7],(728,334) [6,0,0,0,0,4],0,3,[2,1,-1,0,6],[1,0,-1,0,8],[1,0,-1,0,9],(727,279) [6,0,0,0,0,4],3,1,[1,0,-1,0,7],(680,252) [6,0,0,0,0,4],0,3,[1,0,-1,0,7],[2,0,-1,0,0],[1,0,-1,0,10],(775,253) [6,0,0,0,0,4],0,3,[1,0,-1,0,9],[1,0,-1,0,11],[2,1,-1,0,12],(823,280) [6,0,0,0,0,4],3,1,[1,0,-1,0,10],(872,254) [6,0,0,0,0,4],1,2,[2,1,-1,0,10],[1,0,-1,0,4],(824,335) reaction_nb: 0 Num_Atom: 4 Key_Num: -1 GenSubs_Ids: -1 -1 -1 [35,0,0,0,0,1],0,1,[1,0,-1,0,1],(437,359) [6,0,0,0,0,4],2,2,[1,0,-1,0,2],[1,0,-1,0,0],(405,377) [6,0,0,0,0,4],1,2,[1,0,-1,0,1],[2,0,-1,0,3],(371,358) [6,0,0,0,0,4],2,1,[2,0,-1,0,2],(334,377) reaction_nb: 0 Num_Atom: 14 Key_Num: -1 GenSubs_Ids: -1 -1 -1 [8,0,0,0,0,2],0,1,[2,0,-1,0,7],(1211,626) [8,0,0,0,0,2],0,2,[1,8,-1,0,4],[1,8,-1,0,5],(1116,737) [6,0,0,0,0,4],3,1,[1,6,-1,0,3],(1183,837) [6,0,0,0,0,4],0,4,[1,5,-1,0,2],[1,0,-1,0,4],[1,0,-1,0,10],[1,7,-1,0,13],(1211,789) [6,0,0,0,0,4],1,3,[1,0,-1,0,3],[1,0,-1,0,5],[1,7,-1,0,1],(1163,762) [6,0,0,0,0,4],0,4,[1,0,-1,0,4],[1,5,-1,0,6],[1,0,-1,0,7],[1,7,-1,0,1],(1163,708) [6,0,0,0,0,4],3,1,[1,6,-1,0,5],(1116,678) [6,0,0,0,0,4],0,3,[1,0,-1,0,5],[2,0,-1,0,0],[1,0,-1,0,8],(1213,683) [6,0,0,0,0,4],0,3,[1,0,-1,0,7],[1,0,-1,0,9],[2,1,-1,0,10],(1258,709) [6,0,0,0,0,4],3,1,[1,0,-1,0,8],(1309,683) [6,0,0,0,0,4],1,2,[2,1,-1,0,8],[1,0,-1,0,3],(1259,764) [6,0,0,0,0,4],3,1,[1,0,-1,0,12],(1236,911) [6,0,0,0,0,4],2,2,[1,0,-1,0,11],[1,0,-1,0,13],(1214,877) [6,0,0,0,0,4],2,2,[1,0,-1,0,12],[1,8,-1,0,3],(1246,835) reaction_nb: 0 Num_Atom: 16 Key_Num: -1 GenSubs_Ids: -1 -1 -1 [8,0,0,0,0,2],0,1,[2,0,-1,0,8],(524,619) [5,0,0,0,0,3],2,1,[1,6,-1,0,7],(411,669) [8,0,0,0,0,2],0,2,[1,0,-1,0,13],[1,2,-1,0,6],(429,781) [8,0,0,0,0,2],0,1,[2,0,-1,0,13],(382,865) [6,0,0,0,0,4],3,1,[1,6,-1,0,5],(564,822) [6,0,0,0,0,4],0,4,[1,5,-1,0,4],[1,0,-1,0,6],[1,0,-1,0,11],[1,7,-1,0,14],(525,780) [6,0,0,0,0,4],1,3,[1,0,-1,0,5],[1,0,-1,0,7],[1,2,-1,0,2],(477,754) [6,0,0,0,0,4],0,4,[1,0,-1,0,6],[1,5,-1,0,1],[1,0,-1,0,8],[1,7,-1,0,15],(478,700) [6,0,0,0,0,4],0,3,[1,0,-1,0,7],[2,0,-1,0,0],[1,0,-1,0,9],(526,674) [6,0,0,0,0,4],0,3,[1,0,-1,0,8],[1,0,-1,0,10],[2,1,-1,0,11],(572,701) [6,0,0,0,0,4],3,1,[1,0,-1,0,9],(622,675) [6,0,0,0,0,4],1,2,[2,1,-1,0,9],[1,0,-1,0,5],(573,756) [6,0,0,0,0,4],2,2,[1,0,-1,0,13],[1,0,-1,0,14],(479,863) [6,0,0,0,0,4],0,3,[1,0,-1,0,12],[2,0,-1,0,3],[1,0,-1,0,2],(429,837) [6,0,0,0,0,4],2,2,[1,0,-1,0,12],[1,8,-1,0,5],(525,837) [6,0,0,0,0,4],3,1,[1,8,-1,0,7],(458,650) reaction_nb: 0 Num_Atom: 16 Key_Num: 0 GenSubs_Ids: -1 -1 -1 [8,0,0,0,0,2],0,1,[2,0,-1,0,9],(1033,1130) [8,0,0,0,0,2],0,2,[1,2,-1,0,6],[1,8,-1,0,7],(937,1239) [8,0,0,0,0,2],0,2,[1,0,-1,0,15],[1,2,-1,0,12],(1128,1294) [8,0,0,0,0,2],0,1,[2,0,-1,0,15],(1177,1375) [6,0,0,0,0,4],3,1,[1,6,-1,0,5],(992,1330) [6,0,0,0,0,4],0,4,[1,5,-1,0,4],[1,0,-1,0,6],[1,0,-1,0,12],[1,7,-1,0,14],(1032,1294) [6,0,0,0,0,4],1,3,[1,0,-1,0,5],[1,0,-1,0,7],[1,2,-1,0,1],(984,1266) [6,0,0,0,0,4],0,4,[1,0,-1,0,6],[1,5,-1,0,8],[1,0,-1,0,9],[1,7,-1,0,1],(984,1212) [6,0,0,0,0,4],3,1,[1,6,-1,0,7],(938,1182) [6,0,0,0,0,4],0,3,[1,0,-1,0,7],[2,0,-1,0,0],[1,0,-1,0,10],(1035,1185) [6,0,0,0,0,4],1,3,[1,0,-1,0,9],[1,5,-1,0,11],[1,0,-1,0,12],(1080,1212) [6,0,0,0,0,4],3,1,[1,6,-1,0,10],(1130,1187) [6,0,0,0,0,4],1,3,[1,0,-1,0,10],[1,0,-1,0,5],[1,2,-1,0,2],(1081,1267) [6,0,0,0,0,4],2,2,[1,0,-1,0,14],[1,0,-1,0,15],(1082,1374) [6,0,0,0,0,4],2,2,[1,0,-1,0,13],[1,8,-1,0,5],(1032,1347) [6,0,0,0,0,4],0,3,[1,0,-1,0,13],[1,0,-1,0,2],[2,0,-1,0,3],(1128,1350) reaction_nb: 0 Num_Atom: 18 Key_Num: 0 GenSubs_Ids: -1 -1 -1 [8,0,0,0,0,2],0,1,[2,0,-1,0,10],(162,1118) [5,0,0,0,0,3],2,1,[1,6,-1,0,11],(259,1172) [8,0,0,0,0,2],0,2,[1,2,-1,0,7],[1,8,-1,0,8],(67,1229) [8,0,0,0,0,2],0,2,[1,0,-1,0,16],[1,2,-1,0,12],(261,1284) [8,0,0,0,0,2],0,1,[2,0,-1,0,16],(308,1364) [6,0,0,0,0,4],3,1,[1,6,-1,0,6],(123,1318) [6,0,0,0,0,4],0,4,[1,5,-1,0,5],[1,0,-1,0,7],[1,0,-1,0,12],[1,0,-1,0,13],(163,1282) [6,0,0,0,0,4],1,3,[1,0,-1,0,6],[1,0,-1,0,8],[1,2,-1,0,2],(116,1255) [6,0,0,0,0,4],0,4,[1,0,-1,0,7],[1,5,-1,0,9],[1,0,-1,0,10],[1,7,-1,0,2],(117,1200) [6,0,0,0,0,4],3,1,[1,6,-1,0,8],(72,1169) [6,0,0,0,0,4],0,3,[1,0,-1,0,8],[2,0,-1,0,0],[1,0,-1,0,11],(164,1174) [6,0,0,0,0,4],0,4,[1,0,-1,0,10],[1,5,-1,0,1],[1,0,-1,0,12],[1,2,-1,0,17],(212,1202) [6,0,0,0,0,4],1,3,[1,0,-1,0,11],[1,0,-1,0,6],[1,2,-1,0,3],(212,1257) [6,0,0,0,0,4],2,2,[1,0,-1,0,6],[1,2,-1,0,15],(164,1297) [6,0,0,0,0,4],2,2,[1,0,-1,0,15],[1,0,-1,0,16],(211,1363) [6,0,0,0,0,4],2,2,[1,0,-1,0,14],[1,2,-1,0,13],(164,1338) [6,0,0,0,0,4],0,3,[1,0,-1,0,14],[1,0,-1,0,3],[2,0,-1,0,4],(261,1339) [6,0,0,0,0,4],3,1,[1,2,-1,0,11],(229,1152) reaction_nb: 0 Num_Atom: 16 Key_Num: -1 GenSubs_Ids: -1 -1 -1 [8,0,0,0,0,2],0,1,[2,0,-1,0,9],(162,1580) [1181,0,0,0,0,1],0,1,[1,8,-1,1,6],(68,1743) [8,0,0,0,0,2],0,2,[1,0,-1,0,15],[1,8,-1,0,12],(258,1746) [8,0,0,0,0,2],0,1,[2,0,-1,0,15],(306,1827) [6,0,0,0,0,4],3,1,[1,6,-1,0,5],(120,1781) [6,0,0,0,0,4],0,4,[1,5,-1,0,4],[1,0,-1,0,6],[1,0,-1,0,12],[1,7,-1,0,14],(162,1746) [6,0,0,0,0,4],1,3,[1,0,-1,0,5],[1,0,-1,0,7],[1,7,-1,0,1],(114,1717) [6,0,0,0,0,4],1,3,[1,0,-1,0,6],[1,5,-1,0,8],[1,0,-1,0,9],(114,1662) [6,0,0,0,0,4],3,1,[1,6,-1,0,7],(69,1631) [6,0,0,0,0,4],0,3,[1,0,-1,0,7],[2,0,-1,0,0],[1,0,-1,0,10],(164,1636) [6,0,0,0,0,4],1,3,[1,0,-1,0,9],[1,5,-1,0,11],[1,0,-1,0,12],(210,1663) [6,0,0,0,0,4],3,1,[1,6,-1,0,10],(257,1637) [6,0,0,0,0,4],1,3,[1,0,-1,0,10],[1,0,-1,0,5],[1,7,-1,0,2],(210,1719) [6,0,0,0,0,4],2,2,[1,0,-1,0,14],[1,0,-1,0,15],(211,1827) [6,0,0,0,0,4],2,2,[1,0,-1,0,13],[1,8,-1,0,5],(161,1800) [6,0,0,0,0,4],0,3,[1,0,-1,0,13],[1,0,-1,0,2],[2,0,-1,0,3],(258,1801) reaction_nb: 0 Num_Atom: 16 Key_Num: -1 GenSubs_Ids: -1 -1 -1 [457,0,0,0,0,1],0,1,[1,8,-1,0,8],(1032,1592) [8,0,0,0,0,2],0,2,[1,0,-1,0,14],[1,8,-1,0,11],(1126,1757) [8,0,0,0,0,2],0,1,[2,0,-1,0,14],(1174,1840) [6,0,0,0,0,4],3,1,[1,0,-1,0,4],(990,1794) [6,0,0,0,0,4],0,4,[1,0,-1,0,3],[1,0,-1,0,5],[1,0,-1,0,11],[1,7,-1,0,13],(1031,1758) [6,0,0,0,0,4],1,3,[1,0,-1,0,4],[1,0,-1,0,6],[1,2,-1,0,15],(983,1728) [6,0,0,0,0,4],1,3,[1,0,-1,0,5],[1,5,-1,0,7],[1,0,-1,0,8],(983,1673) [6,0,0,0,0,4],3,1,[1,6,-1,0,6],(939,1644) [6,0,0,0,0,4],1,3,[1,0,-1,0,6],[1,0,-1,0,9],[1,7,-1,0,0],(1031,1647) [6,0,0,0,0,4],1,3,[1,0,-1,0,8],[1,5,-1,0,10],[1,0,-1,0,11],(1079,1674) [6,0,0,0,0,4],3,1,[1,6,-1,0,9],(1128,1648) [6,0,0,0,0,4],1,3,[1,0,-1,0,9],[1,0,-1,0,4],[1,7,-1,0,1],(1079,1729) [6,0,0,0,0,4],2,2,[1,0,-1,0,13],[1,0,-1,0,14],(1080,1838) [6,0,0,0,0,4],2,2,[1,0,-1,0,12],[1,8,-1,0,4],(1030,1812) [6,0,0,0,0,4],0,3,[1,0,-1,0,12],[1,0,-1,0,1],[2,0,-1,0,2],(1126,1813) [6,0,0,0,0,4],3,1,[1,2,-1,0,5],(949,1748) reaction_nb: 0 Num_Atom: 16 Key_Num: -1 GenSubs_Ids: -1 -1 -1 [457,0,0,0,0,1],0,1,[1,2,-1,0,7],(1029,2004) [8,0,0,0,0,2],0,1,[2,0,-1,0,10],(1123,2169) [6,0,0,0,0,4],3,1,[1,6,-1,0,3],(986,2206) [6,0,0,0,0,4],0,4,[1,5,-1,0,2],[1,0,-1,0,4],[1,0,-1,0,10],[1,2,-1,0,12],(1026,2169) [6,0,0,0,0,4],1,3,[1,0,-1,0,3],[1,0,-1,0,5],[1,7,-1,0,15],(979,2141) [6,0,0,0,0,4],1,3,[1,0,-1,0,4],[1,5,-1,0,6],[1,0,-1,0,7],(979,2085) [6,0,0,0,0,4],3,1,[1,6,-1,0,5],(935,2055) [6,0,0,0,0,4],1,3,[1,0,-1,0,5],[1,0,-1,0,8],[1,2,-1,0,0],(1027,2059) [6,0,0,0,0,4],1,3,[1,0,-1,0,7],[1,5,-1,0,9],[1,0,-1,0,10],(1075,2086) [6,0,0,0,0,4],3,1,[1,6,-1,0,8],(1125,2060) [6,0,0,0,0,4],0,3,[1,0,-1,0,8],[2,0,-1,0,1],[1,0,-1,0,3],(1075,2141) [6,0,0,0,0,4],1,3,[1,0,-1,0,12],[1,0,-1,0,13],[1,7,-1,0,14],(1074,2251) [6,0,0,0,0,4],2,2,[1,0,-1,0,11],[1,2,-1,0,3],(1027,2225) [6,0,0,0,0,4],3,1,[1,0,-1,0,11],(1112,2232) [6,0,0,0,0,4],3,1,[1,8,-1,0,11],(1074,2304) [6,0,0,0,0,4],3,1,[1,8,-1,0,4],(946,2160) reaction_nb: 0 Num_Atom: 17 Key_Num: -1 GenSubs_Ids: -1 -1 -1 [457,0,0,0,0,1],0,1,[1,8,-1,0,8],(160,1993) [8,0,0,0,0,2],0,2,[1,0,-1,0,14],[1,8,-1,0,11],(255,2160) [8,0,0,0,0,2],0,1,[2,0,-1,0,14],(301,2241) [6,0,0,0,0,4],3,1,[1,6,-1,0,4],(117,2194) [6,0,0,0,0,4],0,4,[1,5,-1,0,3],[1,0,-1,0,5],[1,0,-1,0,11],[1,7,-1,0,13],(157,2158) [6,0,0,0,0,4],1,3,[1,0,-1,0,4],[1,0,-1,0,6],[1,7,-1,0,15],(110,2130) [6,0,0,0,0,4],1,3,[1,0,-1,0,5],[1,5,-1,0,7],[1,0,-1,0,8],(110,2074) [6,0,0,0,0,4],3,1,[1,6,-1,0,6],(69,2045) [6,0,0,0,0,4],1,3,[1,0,-1,0,6],[1,0,-1,0,9],[1,7,-1,0,0],(159,2048) [6,0,0,0,0,4],1,3,[1,0,-1,0,8],[1,5,-1,0,10],[1,0,-1,0,11],(206,2075) [6,0,0,0,0,4],3,1,[1,6,-1,0,9],(256,2050) [6,0,0,0,0,4],1,3,[1,0,-1,0,9],[1,0,-1,0,4],[1,7,-1,0,1],(207,2132) [6,0,0,0,0,4],1,3,[1,0,-1,0,13],[1,0,-1,0,14],[1,2,-1,0,16],(206,2241) [6,0,0,0,0,4],2,2,[1,0,-1,0,12],[1,8,-1,0,4],(158,2215) [6,0,0,0,0,4],0,3,[1,0,-1,0,12],[1,0,-1,0,1],[2,0,-1,0,2],(255,2214) [6,0,0,0,0,4],3,1,[1,8,-1,0,5],(77,2149) [6,0,0,0,0,4],3,1,[1,2,-1,0,12],(205,2293) reaction_nb: 0 27 GenSubs_Id: -1 0 0 0 0 UNCLASSIFIED 1 620 82 654 53 1 620 82 654 53 \[7,p]{B:} GenSubs_Id: -1 0 0 0 0 UNCLASSIFIED 1 156 84 452 47 4 156 84 452 47 \[7,p]{2.} \[7,p]{Synthesis} \[7,p]{of} \[7,p]{the} GenSubs_Id: -1 0 0 0 0 UNCLASSIFIED 1 1046 299 1278 270 4 1046 299 1278 270 \[7,b]{I.} \[7,b]{BH3,} \[7,b]{THF,} \[7,b]{0°C;} GenSubs_Id: -1 0 0 0 0 UNCLASSIFIED 1 389 319 499 291 1 389 319 499 291 \[7,b]{NaOMe;} GenSubs_Id: -1 0 0 0 0 UNCLASSIFIED 1 1074 332 1305 302 3 1074 332 1305 302 \[7,b]{H2O2,} \[7,b]{NaOH,} \[7,b]{0°C} GenSubs_Id: -1 0 0 0 0 UNCLASSIFIED 1 465 385 537 360 1 465 385 537 360 \[7,b]{,PhH} GenSubs_Id: -1 0 0 0 0 UNCLASSIFIED 1 1044 398 1252 366 3 1044 398 1252 366 \[7,b]{2.} \[7,b]{Cr03,} \[7,b]{HZSO4,} GenSubs_Id: -1 0 0 0 0 UNCLASSIFIED 1 1074 422 1170 402 1 1074 422 1170 402 \[7,b]{acetone} GenSubs_Id: -1 0 0 0 0 UNCLASSIFIED 1 45 741 227 709 3 45 741 227 709 \[7,b]{Bry,} \[7,b]{KBr,} \[7,b]{H20} GenSubs_Id: -1 0 0 0 0 UNCLASSIFIED 1 757 747 949 720 3 757 747 949 720 \[7,b]{aq.} \[7,b]{KOH,} \[7,b]{THF} GenSubs_Id: -1 0 0 0 0 UNCLASSIFIED 1 1459 762 1647 732 3 1459 762 1647 732 \[7,b]{Br2,} \[7,b]{KBr,} \[7,b]{H20} GenSubs_Id: -1 0 0 0 0 UNCLASSIFIED 1 1203 1018 1233 985 1 1203 1018 1233 985 \[7,b]{C} GenSubs_Id: -1 0 0 0 0 UNCLASSIFIED 1 483 1242 723 1212 2 483 1242 723 1212 \[7,b]{(rt-Bu)3SnH,} \[7,b]{AIBN} GenSubs_Id: -1 0 0 0 0 UNCLASSIFIED 1 1414 1252 1632 1221 2 1414 1252 1632 1221 \[7,b]{Al/Hg,} \[7,b]{THFIH20} GenSubs_Id: -1 0 0 0 0 UNCLASSIFIED 1 534 1303 670 1277 2 534 1303 670 1277 \[7,b]{PhH,} \[7,b]{75°C} GenSubs_Id: -1 0 0 0 0 UNCLASSIFIED 1 1440 1309 1605 1286 3 1440 1309 1605 1286 \[7,b]{0°C} \[7,b]{->} \[7,b]{-10°C} GenSubs_Id: -1 0 0 0 0 UNCLASSIFIED 1 897 1474 1197 1446 6 897 1474 1197 1446 \[7,p]{87} \[7,p]{:} \[7,p]{13} \[7,i]{mixture} \[7,i]{at} \[7,i]{C*} GenSubs_Id: -1 0 0 0 0 UNCLASSIFIED 1 503 1691 656 1661 4 503 1691 656 1661 \[7,b]{t.} \[7,b]{H2,} \[7,b]{Ra} \[7,b]{Ni} GenSubs_Id: -1 0 0 0 0 UNCLASSIFIED 1 531 1722 689 1694 2 531 1722 689 1694 \[7,b]{DME,} \[7,b]{-20°C} GenSubs_Id: -1 0 0 0 0 UNCLASSIFIED 1 1347 1729 1584 1701 3 1347 1729 1584 1701 \[7,b]{LDA,} \[7,b]{THF,} \[7,b]{-78°C;} GenSubs_Id: -1 0 0 0 0 UNCLASSIFIED 1 501 1788 642 1759 3 501 1788 642 1759 \[7,b]{2.} \[7,b]{BzCI,} \[7,b]{Py} GenSubs_Id: -1 0 0 0 0 UNCLASSIFIED 2 1371 1822 1560 1766 2 1382 1794 1550 1766 \[7,b]{MeI,} \[7,b]{HMPA,} 3 1371 1822 1560 1799 \[7,b]{-78°C} \[7,b]{~} \[7,b]{-45°C} GenSubs_Id: -1 0 0 0 0 UNCLASSIFIED 1 477 2135 652 2103 3 477 2135 652 2103 \[7,b]{t.} \[7,b]{LiOH,} \[7,b]{HZO} GenSubs_Id: -1 0 0 0 0 UNCLASSIFIED 1 1374 2142 1496 2111 1 1374 2142 1496 2111 \[7,b]{MeCO~H} GenSubs_Id: -1 0 0 0 0 UNCLASSIFIED 1 1351 2204 1517 2177 2 1351 2204 1517 2177 \[7,b]{EtOAc,} \[7,b]{55°C} GenSubs_Id: -1 0 0 0 0 UNCLASSIFIED 2 475 2228 684 2169 3 475 2201 675 2169 \[7,b]{2.} \[7,b]{Cr03,} \[7,b]{H2504} 2 499 2228 684 2203 \[7,b]{acetone,} \[7,b]{-10°C} GenSubs_Id: -1 0 0 0 0 UNCLASSIFIED 3 16 2460 367 2351 4 16 2385 367 2351 \[7,i]{major} \[7,i]{and} \[7,i]{minor} \[7,i]{epimers} 5 46 2421 329 2389 \[7,i]{at} \[7,i]{C*} \[7,i]{gave} \[7,i]{the} \[7,i]{same} 2 31 2460 348 2425 \[7,i]{saponification} \[7,i]{product} 11 Num_Atom: 3 Key_Num: 0 GenSubs_Ids: -1 -1 -1 [6,0,0,0,0,4],2,2,[1,0,-1,0,1],[1,6,-1,0,2],(548,337) [6,0,0,0,0,4],3,1,[1,0,-1,0,0],(315,334) [6,0,0,0,0,4],3,1,[1,5,-1,0,0],(585,338) reaction_nb: 0 1 1 3 1 2 2 4 1 [(585,338),(546,337)] 1 [(315,334),(548,337)] Num_Atom: 3 Key_Num: 0 GenSubs_Ids: -1 -1 -1 [6,0,0,0,0,4],2,2,[1,0,-1,0,1],[1,6,-1,0,2],(1309,346) [6,0,0,0,0,4],3,1,[1,0,-1,0,0],(1018,342) [6,0,0,0,0,4],3,1,[1,5,-1,0,0],(1345,347) reaction_nb: 0 1 1 1 1 1 3 1 [(1345,347),(1306,346)] 1 [(1018,342),(1309,346)] Num_Atom: 3 Key_Num: 0 GenSubs_Ids: -1 -1 -1 [6,0,0,0,0,4],2,2,[1,0,-1,0,1],[1,6,-1,0,2],(231,760) [6,0,0,0,0,4],3,1,[1,0,-1,0,0],(27,757) [6,0,0,0,0,4],3,1,[1,5,-1,0,0],(268,762) reaction_nb: 0 1 1 6 1 1 1 1 [(268,762),(229,760)] 1 [(27,757),(231,760)] Num_Atom: 3 Key_Num: 0 GenSubs_Ids: -1 -1 -1 [6,0,0,0,0,4],2,2,[1,0,-1,0,1],[1,6,-1,0,2],(954,770) [6,0,0,0,0,4],3,1,[1,0,-1,0,0],(738,767) [6,0,0,0,0,4],3,1,[1,5,-1,0,0],(991,770) reaction_nb: 0 1 1 5 1 1 6 1 [(991,770),(952,769)] 1 [(738,767),(954,770)] Num_Atom: 3 Key_Num: 0 GenSubs_Ids: -1 -1 -1 [6,0,0,0,0,4],2,2,[1,0,-1,0,1],[1,6,-1,0,2],(1659,776) [6,0,0,0,0,4],3,1,[1,0,-1,0,0],(1428,774) [6,0,0,0,0,4],3,1,[1,5,-1,0,0],(1694,778) reaction_nb: 0 1 1 8 1 1 5 1 [(1694,778),(1657,776)] 1 [(1428,774),(1659,776)] Num_Atom: 3 Key_Num: 0 GenSubs_Ids: -1 -1 -1 [6,0,0,0,0,4],2,2,[1,0,-1,0,1],[1,6,-1,0,2],(723,1261) [6,0,0,0,0,4],3,1,[1,0,-1,0,0],(462,1258) [6,0,0,0,0,4],3,1,[1,5,-1,0,0],(758,1261) reaction_nb: 0 1 1 7 1 1 8 1 [(758,1261),(721,1260)] 1 [(462,1258),(723,1261)] Num_Atom: 3 Key_Num: 0 GenSubs_Ids: -1 -1 -1 [6,0,0,0,0,4],2,2,[1,0,-1,0,1],[1,6,-1,0,2],(1632,1270) [6,0,0,0,0,4],3,1,[1,0,-1,0,0],(1388,1268) [6,0,0,0,0,4],3,1,[1,5,-1,0,0],(1666,1270) reaction_nb: 0 1 1 9 1 1 7 1 [(1666,1270),(1629,1270)] 1 [(1388,1268),(1632,1270)] Num_Atom: 3 Key_Num: 0 GenSubs_Ids: -1 -1 -1 [6,0,0,0,0,4],2,2,[1,0,-1,0,1],[1,6,-1,0,2],(698,1740) [6,0,0,0,0,4],3,1,[1,0,-1,0,0],(475,1737) [6,0,0,0,0,4],3,1,[1,5,-1,0,0],(734,1741) reaction_nb: 0 1 1 10 1 1 9 1 [(734,1741),(697,1740)] 1 [(475,1737),(698,1740)] Num_Atom: 3 Key_Num: 0 GenSubs_Ids: -1 -1 -1 [6,0,0,0,0,4],2,2,[1,0,-1,0,1],[1,6,-1,0,2],(1605,1750) [6,0,0,0,0,4],3,1,[1,0,-1,0,0],(1320,1747) [6,0,0,0,0,4],3,1,[1,5,-1,0,0],(1640,1750) reaction_nb: 0 1 1 12 1 1 10 1 [(1640,1750),(1602,1750)] 1 [(1320,1747),(1605,1750)] Num_Atom: 3 Key_Num: 0 GenSubs_Ids: -1 -1 -1 [6,0,0,0,0,4],2,2,[1,0,-1,0,1],[1,6,-1,0,2],(689,2151) [6,0,0,0,0,4],3,1,[1,0,-1,0,0],(459,2147) [6,0,0,0,0,4],3,1,[1,5,-1,0,0],(724,2151) reaction_nb: 0 1 1 11 1 1 12 1 [(724,2151),(686,2150)] 1 [(459,2147),(689,2151)] Num_Atom: 3 Key_Num: 0 GenSubs_Ids: -1 -1 -1 [6,0,0,0,0,4],2,2,[1,0,-1,0,1],[1,6,-1,0,2],(1519,2159) [6,0,0,0,0,4],3,1,[1,0,-1,0,0],(1329,2157) [6,0,0,0,0,4],3,1,[1,5,-1,0,0],(1554,2159) reaction_nb: 0 1 0 1 1 11 1 [(1554,2159),(1515,2158)] 1 [(1329,2157),(1519,2159)] Num_gen_blocks: 0