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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
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Single/Multi-component
Isotopically Labeled
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Found 39 results

Search term: C30H38O2 (Found by molecular formula)
12
IDStructureMolecular FormulaMolecular Weight# of Data Sources# of References# of PubMed# of RSC
9706857

6 of 6 defined stereocentres - 6/6 defined
InChI=1/C30H38O2/c1-17-11-25(31)23(27(3)9-7-19-15-29(19,27)5)13-21(17)22-14-24(26(32)12-18(22)2)28(4)10-8-20-16-30(20,28)6/h11-14,19-20,31-32H,7-10,15-16H2,1-6H3/t19-,20-,27+,28+,29+,30+/m1/s1
C30H38O2430.62158800
28530918

Double-bond stereo
InChI=1/C30H38O2/c1-6-7-8-13-22(2)14-11-15-23(3)16-12-17-24(4)20-21-26-25(5)29(31)27-18-9-10-19-28(27)30(26)32/h6-7,9-10,14,16,18-20H,8,11-13,15,17,21H2,1-5H3/b7-6+,22-14+,23-16+,24-20+
C30H38O2430.62158700
8725990

Double-bond stereo

1 of 1 defined stereocentres - 1/1 defined
InChI=1/C30H38O2/c1-23(12-8-9-13-24(2)15-11-17-26(4)22-31)14-10-16-25(3)18-19-29-27(5)20-28(32)21-30(29,6)7/h8-17,22,28,32H,20-21H2,1-7H3/b9-8+,14-10+,15-11+,23-12+,24-13+,25-16+,26-17+/t28-/m1/s1
C30H38O2430.62157600
59700359

Double-bond stereo
InChI=1/C30H38O2/c1-24(2)14-10-17-27(5)20-11-18-25(3)15-8-9-16-26(4)19-12-21-28(6)22-13-23-29(7)30(31)32/h8-23H,1-7H3,(H,31,32)/b9-8+,17-10+,18-11+,19-12+,22-13+,25-15+,26-16+,27-20+,28-21+,29-23+
C30H38O2430.62155600
60488772

Double-bond stereo
InChI=1/C30H38O2/c1-6-7-8-13-22(2)14-11-15-23(3)16-12-17-24(4)20-21-26-25(5)29(31)27-18-9-10-19-28(27)30(26)32/h6-7,9-10,14,16,18-20H,8,11-13,15,17,21H2,1-5H3/b7-6+,22-14u,23-16u,24-20u
C30H38O2430.62155500
71051576
InChI=1/C30H38O2/c1-4-6-11-23-31-28-19-15-26(16-20-28)30(3,25-13-9-8-10-14-25)27-17-21-29(22-18-27)32-24-12-7-5-2/h8-10,13-22H,4-7,11-12,23-24H2,1-3H3
C30H38O2430.62155500
28592920
InChI=1/C30H38O2/c1-3-5-7-15-21-31-29-23-28(26-19-13-10-14-20-26)30(32-22-16-8-6-4-2)24-27(29)25-17-11-9-12-18-25/h9-14,17-20,23-24H,3-8,15-16,21-22H2,1-2H3
C30H38O2430.62154300
35776004
InChI=1/C30H38O2/c1-21(2)31-27-16-12-23(13-17-27)29(5,6)25-10-9-11-26(20-25)30(7,8)24-14-18-28(19-15-24)32-22(3)4/h9-22H,1-8H3
C30H38O2430.62154300
35776006
InChI=1/C30H38O2/c1-21(2)31-27-17-13-25(14-18-27)29(5,6)23-9-11-24(12-10-23)30(7,8)26-15-19-28(20-16-26)32-22(3)4/h9-22H,1-8H3
C30H38O2430.62154300
3852645

0 of 4 defined stereocentres - 0/4 defined
InChI=1/C30H38O2/c1-20(2)10-9-11-21(3)26-15-16-27-25-14-17-28(22(4)24(25)18-19-30(26,27)5)32-29(31)23-12-7-6-8-13-23/h6-8,12-14,17-21,26-27H,9-11,15-16H2,1-5H3
C30H38O2430.62154300
8313096

Double-bond stereo
InChI=1/C30H38O2/c1-22(2)14-12-16-24(4)18-13-17-23(3)15-8-6-7-9-19-26-25(5)29(31)27-20-10-11-21-28(27)30(26)32/h7,9-11,14-15,18,20-21H,6,8,12-13,16-17,19H2,1-5H3/b9-7+,23-15+,24-18+
C30H38O2430.62154300
9971565

6 of 6 defined stereocentres - 6/6 defined
InChI=1/C30H38O2/c1-29-17-15-23(31)20-27(29)22(12-8-4-7-11-21-9-5-3-6-10-21)19-24-25-13-14-28(32)30(25,2)18-16-26(24)29/h3,5-6,9-10,15,17,20,22,24-26H,4,7-8,11-14,16,18-19H2,1-2H3/t22-,24+,25+,26+,29-,30+/m1/s1
C30H38O2430.62152100
9971566

4 of 4 defined stereocentres - 4/4 defined
InChI=1/C30H38O2/c1-7-25(29(19-23(5)31)27-13-9-21(3)10-14-27)17-18-26(8-2)30(20-24(6)32)28-15-11-22(4)12-16-28/h7-16,25-26,29-30H,1-2,17-20H2,3-6H3/t25-,26+,29-,30+
C30H38O2430.62152100
8725991

3 of 4 defined stereocentres - 3/4 defined
InChI=1/C30H38O2/c1-20(2)24(17-21-11-7-6-8-12-21)26(31)32-27-29(5)16-15-25(28(29,3)4)30(27)18-22-13-9-10-14-23(22)19-30/h6-14,20,24-25,27H,15-19H2,1-5H3/t24?,25-,27-,29-/m0/s1
C30H38O2430.62152100
8869293

6 of 6 defined stereocentres - 6/6 defined
InChI=1/C30H38O2/c1-29-17-15-23(31)20-27(29)22(12-8-4-7-11-21-9-5-3-6-10-21)19-24-25-13-14-28(32)30(25,2)18-16-26(24)29/h3,5-6,9-10,15,17,20,22,24-26H,4,7-8,11-14,16,18-19H2,1-2H3/t22-,24-,25-,26-,29+,30-/m0/s1
C30H38O2430.62152100
8940421

5 of 5 defined stereocentres - 5/5 defined
InChI=1/C30H38O2/c1-29-17-15-23(31)20-27(29)22(12-8-4-7-11-21-9-5-3-6-10-21)19-24-25-13-14-28(32)30(25,2)18-16-26(24)29/h3,5-6,9-10,19-20,24-26H,4,7-8,11-18H2,1-2H3/t24-,25-,26-,29+,30-/m0/s1
C30H38O2430.62152100
9114156

6 of 7 defined stereocentres - 6/7 defined
InChI=1/C30H38O2/c1-19(31)24-11-12-25-23-10-9-22-18-21(28-13-8-20-6-4-5-7-27(20)32-28)14-16-29(22,2)26(23)15-17-30(24,25)3/h4-7,9,18,23-26,28H,8,10-17H2,1-3H3/t23-,24+,25-,26-,28?,29-,30+/m0/s1
C30H38O2430.62152100
9114157

2 of 5 defined stereocentres - 2/5 defined
InChI=1/C30H38O2/c1-2-3-4-5-6-7-8-9-11-14-22-17-18-24-25-19-20-26(27(24)21-22)29-28(25)31-30(32-29)23-15-12-10-13-16-23/h10,12-13,15-21,25-26,28-30H,2-9,11,14H2,1H3/t25-,26+,28?,29?,30?/m0/s1
C30H38O2430.62152100
9212571

Double-bond stereo

3 of 4 defined stereocentres - 3/4 defined
InChI=1/C30H38O2/c1-22-14-19-27(30(2,3)26-12-8-5-9-13-26)28(20-22)32-29(31)21-23-15-17-25(18-16-23)24-10-6-4-7-11-24/h4-13,21-22,25,27-28H,14-20H2,1-3H3/b23-21-/t22-,25?,27-,28-/m1/s1
C30H38O2430.62152100
61708700

6 of 6 defined stereocentres - 6/6 defined
InChI=1/C30H38O2/c1-17-8-9-22(27(4)13-11-20-16-29(20,27)6)26(31)25(17)21-15-23-24(14-18(21)2)32-30(7)19(3)10-12-28(23,30)5/h8-9,14-15,19-20,31H,10-13,16H2,1-7H3/t19-,20+,27-,28-,29-,30-/m0/s1
C30H38O2430.62152200
12

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