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Found 56 results

Search term: DATA_SOURCE in ('Colin Batchelor')
123
IDStructureMolecular FormulaMolecular Weight# of Data Sources# of References# of PubMed# of RSC
67190

InChI=1/C4H8N2O/c7-4-5-2-1-3-6-4/h1-3H2,(H2,5,6,7)
C4H8N2O100.1191105110328
5293454

InChI=1/C20H21F3N4O/c21-20(22,23)15-4-3-5-16(14-15)26-11-8-25(9-12-26)10-13-27-18-7-2-1-6-17(18)24-19(27)28/h1-7,14H,8-13H2,(H,24,28)
C20H21F3N4O390.402182146310
23347086
InChI=1/C10H9ClN2O2/c1-14-7-4-3-6-8(9(7)15-2)12-5-13-10(6)11/h3-5H,1-2H3
C10H9ClN2O2224.6437684101
91492

7 of 7 defined stereocentres - 7/7 defined
InChI=1/C30H50O/c1-20(2)10-9-11-21(3)22-14-18-30(8)24-12-13-25-27(4,5)26(31)16-17-28(25,6)23(24)15-19-29(22,30)7/h10,21-22,25-26,31H,9,11-19H2,1-8H3/t21-,22-,25-,26-,28+,29-,30+/m0/s1
C30H50O426.71743333652
10002

InChI=1/C4H12As2O/c1-5(2)7-6(3)4/h1-4H3
C4H12As2O225.98071616021
24769409
InChI=1/C16H19NS2.6CH3.2Sn/c1-2-3-4-5-6-7-10-17-13-8-11-18-15(13)16-14(17)9-12-19-16;;;;;;;;/h8-9H,2-7,10H2,1H3;6*1H3;;/rC22H37NS2Sn2/c1-8-9-10-11-12-13-14-23-17-15-19(26(2,3)4)24-21(17)22-18(23)16-20(25-22)27(5,6)7/h15-16H,8-14H2,1-7H3
C22H37NS2Sn2617.085910900
24769428
InChI=1/2Se.Sn/rSe2Sn/c1-3-2
Se2Sn276.637800
9195677

5 of 5 defined stereocentres - 5/5 defined
InChI=1/C15H26O/c1-10-5-6-12-14(4)8-11(14)7-13(2,3)9-15(10,12)16/h10-12,16H,5-9H2,1-4H3/t10-,11+,12+,14-,15-/m1/s1
C15H26O222.36637700
26324642
InChI=1/C22H11Cl5N2O4/c23-9-5-6-15(31)11(7-9)19(32)13-8-12(24)22(27)29(13)18-16(25)21(26)28-17(18)20(33)10-3-1-2-4-14(10)30/h1-8,28,30-31H
C22H11Cl5N2O4544.59877600
26324641
InChI=1/C22H11Cl5N2O4/c23-9-5-6-15(31)11(7-9)20(33)17-18(16(25)21(26)28-17)29-13(8-12(24)22(29)27)19(32)10-3-1-2-4-14(10)30/h1-8,28,30-31H
C22H11Cl5N2O4544.59876500
9733059

Charge
InChI=1/C8H7ClN2OS2.K/c9-6-3-1-5(2-4-6)7(12)10-11-8(13)14;/h1-4H,(H,10,12)(H2,11,13,14);/q;+1/p-1
C8H6ClKN2OS2284.82736700
23486966

9 of 9 defined stereocentres - 9/9 defined
InChI=1/C31H38O11/c1-15-19(34)13-31(38)26(41-27(37)18-10-8-7-9-11-18)24-29(6,20(35)12-21-30(24,14-39-21)42-17(3)33)25(36)23(40-16(2)32)22(15)28(31,4)5/h7-11,19-21,23-24,26,34-35,38H,12-14H2,1-6H3/t19-,20-,21+,23+,24+,26-,29-,30+,31-/m1/s1
C31H38O11586.62685414726
24769410
InChI=1/C2H3.Sn.3H/c1-2;;;;/h1H,2H2;;;;/rC2H6Sn/c1-2-3/h2H,1H2,3H3
C2H6Sn148.77951000
26324643
InChI=1/C22H11BrCl4N2O4/c23-9-5-6-15(31)11(7-9)19(32)13-8-12(24)22(27)29(13)18-16(25)21(26)28-17(18)20(33)10-3-1-2-4-14(10)30/h1-8,28,30-31H
C22H11BrCl4N2O4589.04975400
24785757
InChI=1/C22H25N3S2/c1-2-3-4-5-6-7-14-25-23-21-17(19-10-8-15-26-19)12-13-18(22(21)24-25)20-11-9-16-27-20/h8-13,15-16H,2-7,14H2,1H3
C22H25N3S2395.5844300
25201922
InChI=1/C17H25N3O3/c1-6-8-20(9-7-2)17-12-10-13(21-3)15(22-4)16(23-5)14(12)18-11-19-17/h10-11H,6-9H2,1-5H3
C17H25N3O3319.39874500
26324639

2 of 2 defined stereocentres - 2/2 defined
InChI=1/C26H33NO4/c1-31-26-15-9-20(10-16-26)8-14-25(30)18-22-4-2-3-21(27-22)17-24(29)13-7-19-5-11-23(28)12-6-19/h5-6,9-12,15-16,21-22,27-28H,2-4,7-8,13-14,17-18H2,1H3/t21-,22+/m1/s1
C26H33NO4423.54454400
24593910
InChI=1/C15H6N2O/c16-7-11-13-9-5-1-3-8-4-2-6-10(12(8)9)14(13)17-15(11)18/h1-6H
C15H6N2O230.22094400
24748336

Charge

0 of 3 defined stereocentres - 0/3 defined
InChI=1/C16H20Br3N2O2/c1-20-13(21(2)6-4-5-12(21)16(20)22)7-9-10(17)8-11(18)15(23-3)14(9)19/h8,12-13H,4-7H2,1-3H3/q+1/t12-,13+,21-/m0/s1
C16H20Br3N2O2512.05374401
23344858

Double-bond stereo

2 of 2 defined stereocentres - 2/2 defined
InChI=1/C28H38O7/c1-21(15-18-24(19-26(29)30)20-27(31)32)13-11-9-7-5-6-8-10-12-14-25(35-4)22(2)16-17-23(3)28(33)34/h6,8-12,15-19,21,25H,5,7,13-14,20H2,1-4H3,(H,29,30)(H,31,32)(H,33,34)/b8-6+,11-9+,12-10-,18-15+,22-16-,23-17+,24-19-/t21-,25+/m0/s1
C28H38O7486.59714450
123

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