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Systematic Name, Synonym, Trade Name, Registry Number, SMILES, InChI or CSID

Systematic names 1,2-dihydroxybenzene
Synonyms AIBN
Trade names Aspirin
Registry numbers 7732-18-5
SMILES O=C(OCC)C
InChl InChI=1/CH4/h1H4
Search Hits Limit:
Single/Multi-component
Isotopically Labeled
Additional Filters

Found 37 results

Search term: C33H58OSi (Found by molecular formula)
12
IDStructureMolecular FormulaMolecular Weight# of Data Sources# of References# of PubMed# of RSC
44209377

Double-bond stereo

5 of 5 defined stereocentres - 5/5 defined
InChI=1/C33H58OSi/c1-24(2)13-11-14-26(4)30-20-21-31-27(15-12-22-33(30,31)8)17-18-28-23-29(19-16-25(28)3)34-35(9,10)32(5,6)7/h17-18,24,26,29-31H,3,11-16,19-23H2,1-2,4-10H3/b27-17+,28-18+/t26-,29+,30-,31+,33-/m1/s1
C33H58OSi498.8985151600
9309986

Double-bond stereo

5 of 5 defined stereocentres - 5/5 defined
InChI=1/C33H58OSi/c1-24(2)13-11-14-26(4)30-20-21-31-27(15-12-22-33(30,31)8)17-18-28-23-29(19-16-25(28)3)34-35(9,10)32(5,6)7/h17-18,24,26,29-31H,3,11-16,19-23H2,1-2,4-10H3/b27-17+,28-18-/t26-,29+,30-,31+,33-/m1/s1
C33H58OSi498.89856500
48063662

8 of 8 defined stereocentres - 8/8 defined
InChI=1/C33H58OSi/c1-23(2)12-11-13-24(3)28-16-17-29-27-15-14-25-22-26(34-35(9,10)31(4,5)6)18-20-32(25,7)30(27)19-21-33(28,29)8/h12,14,24,26-30H,11,13,15-22H2,1-10H3/t24-,26+,27+,28-,29+,30+,32+,33-/m1/s1
C33H58OSi498.89855700
58791400

Double-bond stereo

3 of 5 defined stereocentres - 3/5 defined
InChI=1/C33H58OSi/c1-24(2)13-11-14-26(4)30-20-21-31-27(15-12-22-33(30,31)8)17-18-28-23-29(19-16-25(28)3)34-35(9,10)32(5,6)7/h17-18,24,26,29-31H,3,11-16,19-23H2,1-2,4-10H3/b27-17+,28-18+/t26-,29?,30-,31?,33-/m1/s1
C33H58OSi498.89854300
478997

0 of 7 defined stereocentres - 0/7 defined
InChI=1/C33H58OSi/c1-23(2)13-12-14-24(3)25-17-21-33(8)27-15-16-28-30(4,5)29(34-35(9,10)11)19-20-31(28,6)26(27)18-22-32(25,33)7/h13,24-25,28-29H,12,14-22H2,1-11H3
C33H58OSi498.89854700
478998

0 of 8 defined stereocentres - 0/8 defined
InChI=1/C33H58OSi/c1-23(2)13-12-14-24(3)25-17-21-33(8)27-15-16-28-30(4,5)29(34-35(9,10)11)19-20-31(28,6)26(27)18-22-32(25,33)7/h13,18,24-25,27-29H,12,14-17,19-22H2,1-11H3
C33H58OSi498.89853400
532718

0 of 8 defined stereocentres - 0/8 defined
InChI=1/C33H58OSi/c1-28(2)18-19-30(5)20-21-32(7)23(24(30)22-28)12-13-26-31(6)16-15-27(34-35(9,10)11)29(3,4)25(31)14-17-33(26,32)8/h12,24-27H,13-22H2,1-11H3
C33H58OSi498.89853800
550233

0 of 8 defined stereocentres - 0/8 defined
InChI=1/C33H58OSi/c1-22(2)23(3)12-13-24(4)26-16-20-33(8)29-15-14-27-25(5)30(34-35(9,10)11)18-19-31(27,6)28(29)17-21-32(26,33)7/h22,24-27,30H,3,12-21H2,1-2,4-11H3
C33H58OSi498.89853400
551629

0 of 7 defined stereocentres - 0/7 defined
InChI=1/C33H58OSi/c1-23(2)13-12-14-24(3)25-17-21-33(8)27-15-16-28-30(4,5)29(34-35(9,10)11)19-20-31(28,6)26(27)18-22-32(25,33)7/h15,18,23-25,28-29H,12-14,16-17,19-22H2,1-11H3
C33H58OSi498.89853400
9905503

9 of 9 defined stereocentres - 9/9 defined
InChI=1/C33H58OSi/c1-23-24(34-35(9,10)11)12-13-25-30(23,5)15-14-26-31(25,6)19-21-33(8)27-22-28(2,3)16-17-29(27,4)18-20-32(26,33)7/h12,23,25-27H,13-22H2,1-11H3/t23-,25+,26-,27+,29+,30+,31-,32+,33-/m0/s1
C33H58OSi498.89853210
473248

0 of 11 defined stereocentres - 0/11 defined
InChI=1/C33H58OSi/c1-21(2)23(4)33(7)20-30(33)22(3)27-13-14-28-26-12-11-24-19-25(34-35(8,9)10)15-17-31(24,5)29(26)16-18-32(27,28)6/h11,21-23,25-30H,12-20H2,1-10H3
C33H58OSi498.89853400
478559

0 of 9 defined stereocentres - 0/9 defined
InChI=1/C33H58OSi/c1-23(2)12-11-13-24(3)25-16-18-31(7)27-15-14-26-29(4,5)28(34-35(8,9)10)17-19-32(26)22-33(27,32)21-20-30(25,31)6/h12,24-28H,11,13-22H2,1-10H3
C33H58OSi498.89853400
9278234

Double-bond stereo

4 of 5 defined stereocentres - 4/5 defined
InChI=1/C33H58OSi/c1-24(2)14-11-15-25(3)29-21-22-30-28(17-13-23-33(29,30)8)20-19-27-16-12-18-31(26(27)4)34-35(9,10)32(5,6)7/h19-20,24-25,29-31H,4,11-18,21-23H2,1-3,5-10H3/b27-19-,28-20+/t25-,29-,30+,31?,33-/m1/s1
C33H58OSi498.89853200
10001840

8 of 8 defined stereocentres - 8/8 defined
InChI=1/C33H58OSi/c1-23-24(34-35(9,10)11)12-13-25-30(23,5)15-14-26-31(25,6)19-21-33(8)27-22-28(2,3)16-17-29(27,4)18-20-32(26,33)7/h25-27H,12-22H2,1-11H3/t25-,26+,27-,29-,30-,31+,32-,33+/m1/s1
C33H58OSi498.89852100
71061646

Double-bond stereo

4 of 5 defined stereocentres - 4/5 defined
InChI=1/C33H58OSi/c1-24(2)13-11-14-26(4)30-20-21-31-27(15-12-22-33(30,31)8)17-18-28-23-29(19-16-25(28)3)34-35(9,10)32(5,6)7/h17-18,24,26,29-31H,3,11-16,19-23H2,1-2,4-10H3/b27-17+,28-18+/t26-,29+,30-,31?,33-/m1/s1
C33H58OSi498.89852200
58781516

Double-bond stereo

7 of 7 defined stereocentres - 7/7 defined
InChI=1/C33H58OSi/c1-23(2)12-11-13-24(3)28-16-17-29-27-15-14-25-22-26(34-35(9,10)31(4,5)6)18-20-32(25,7)30(27)19-21-33(28,29)8/h13-14,23,26-30H,11-12,15-22H2,1-10H3/b24-13-/t26-,27-,28+,29-,30-,32-,33+/m0/s1
C33H58OSi498.89852200
8499122

Double-bond stereo

5 of 5 defined stereocentres - 5/5 defined
InChI=1/C33H58OSi/c1-24(2)14-11-15-25(3)29-21-22-30-28(17-13-23-33(29,30)8)20-19-27-16-12-18-31(26(27)4)34-35(9,10)32(5,6)7/h19-20,24-25,29-31H,4,11-18,21-23H2,1-3,5-10H3/b27-19-,28-20+/t25-,29-,30+,31+,33-/m1/s1
C33H58OSi498.89852100
8752676

Double-bond stereo
InChI=1/C33H58OSi/c1-12-18-32(27-34-35(10,11)33(7,8)9)26-17-25-30(5)21-14-13-20-29(4)23-16-24-31(6)22-15-19-28(2)3/h12,19-21,24,26H,1,13-18,22-23,25,27H2,2-11H3/b29-20+,30-21+,31-24+,32-26-
C33H58OSi498.89852100
8919286

Double-bond stereo
InChI=1/C33H58OSi/c1-12-18-32(27-34-35(10,11)33(7,8)9)26-14-13-20-29(4)22-16-24-31(6)25-17-23-30(5)21-15-19-28(2)3/h12,19-20,23-24,26H,1,13-18,21-22,25,27H2,2-11H3/b29-20+,30-23+,31-24+,32-26-
C33H58OSi498.89852100
9014361

7 of 7 defined stereocentres - 7/7 defined
InChI=1/C33H58OSi/c1-23(2)12-11-13-24(3)28-16-17-29-27-15-14-25-22-26(34-35(9,10)31(4,5)6)18-20-32(25,7)30(27)19-21-33(28,29)8/h14,22-24,27-30H,11-13,15-21H2,1-10H3/t24-,27+,28-,29+,30+,32+,33-/m1/s1
C33H58OSi498.89852100
12

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