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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 59 results

Search term: C27H46 (Found by molecular formula)
123
IDStructureMolecular FormulaMolecular Weight# of Data Sources# of References# of PubMed# of RSC
389543

7 of 7 defined stereocentres - 7/7 defined
InChI=1/C27H46/c1-19(2)9-8-10-20(3)23-14-15-24-22-13-12-21-11-6-7-17-26(21,4)25(22)16-18-27(23,24)5/h12,19-20,22-25H,6-11,13-18H2,1-5H3/t20-,22+,23-,24+,25+,26+,27-/m1/s1
C27H46370.6541325596298
10825

0 of 7 defined stereocentres - 0/7 defined
InChI=1/C27H46/c1-19(2)9-8-10-20(3)23-14-15-24-22-13-12-21-11-6-7-17-26(21,4)25(22)16-18-27(23,24)5/h12,19-20,22-25H,6-11,13-18H2,1-5H3
C27H46370.6541162796298
10308638

7 of 7 defined stereocentres - 7/7 defined
InChI=1/C27H46/c1-19(2)9-8-10-20(3)23-14-15-24-22-13-12-21-11-6-7-17-26(21,4)25(22)16-18-27(23,24)5/h11,19-20,22-25H,6-10,12-18H2,1-5H3/t20-,22+,23-,24+,25+,26+,27-/m1/s1
C27H46370.654114143246
77640

0 of 7 defined stereocentres - 0/7 defined
InChI=1/C27H46/c1-19(2)9-8-10-20(3)23-14-15-24-22-13-12-21-11-6-7-17-26(21,4)25(22)16-18-27(23,24)5/h11,19-20,22-25H,6-10,12-18H2,1-5H3
C27H46370.6541111300
4937420

7 of 8 defined stereocentres - 7/8 defined
InChI=1/C27H46/c1-19(2)9-8-10-20(3)23-14-15-24-22-13-12-21-11-6-7-17-26(21,4)25(22)16-18-27(23,24)5/h6,11,19-25H,7-10,12-18H2,1-5H3/t20-,21?,22+,23-,24+,25+,26+,27-/m1/s1
C27H46370.65411111074
4521438

Double-bond stereo
InChI=1/C27H46/c1-3-5-7-9-11-13-15-18-22-26(27-24-20-17-21-25-27)23-19-16-14-12-10-8-6-4-2/h17,20-22,24-25H,3-16,18-19,23H2,1-2H3/b26-22+
C27H46370.65418800
240311

0 of 8 defined stereocentres - 0/8 defined
InChI=1/C27H46/c1-19(2)9-8-10-20(3)23-14-15-24-22-13-12-21-11-6-7-17-26(21,4)25(22)16-18-27(23,24)5/h6-7,19-25H,8-18H2,1-5H3
C27H46370.654181300
37282

0 of 8 defined stereocentres - 0/8 defined
InChI=1/C27H46/c1-23(2)14-8-16-25(4)20(23)13-18-27(6)22(25)11-10-21-24(3)15-7-9-19(24)12-17-26(21,27)5/h19-22H,7-18H2,1-6H3
C27H46370.65417700
31529

0 of 8 defined stereocentres - 0/8 defined
InChI=1/C27H46/c1-19(2)9-8-10-20(3)23-14-15-24-22-13-12-21-11-6-7-17-26(21,4)25(22)16-18-27(23,24)5/h6,11,19-25H,7-10,12-18H2,1-5H3
C27H46370.654161000
9265151

8 of 8 defined stereocentres - 8/8 defined
InChI=1/C27H46/c1-19(2)9-8-10-20(3)23-14-15-24-22-13-12-21-11-6-7-17-26(21,4)25(22)16-18-27(23,24)5/h6-7,19-25H,8-18H2,1-5H3/t20-,21-,22+,23-,24+,25+,26+,27-/m1/s1
C27H46370.65416300
10197918

8 of 8 defined stereocentres - 8/8 defined
InChI=1/C27H46/c1-23(2)14-8-16-25(4)20(23)13-18-27(6)22(25)11-10-21-24(3)15-7-9-19(24)12-17-26(21,27)5/h19-22H,7-18H2,1-6H3/t19-,20+,21-,22-,24+,25+,26-,27-/m1/s1
C27H46370.65416600
384780

0 of 8 defined stereocentres - 0/8 defined
InChI=1/C27H46/c1-19(2)9-8-10-20(3)23-14-15-24-22-13-12-21-11-6-7-17-26(21,4)25(22)16-18-27(23,24)5/h7,17,19-25H,6,8-16,18H2,1-5H3
C27H46370.65416600
23255821

7 of 8 defined stereocentres - 7/8 defined
InChI=1/C27H46/c1-19(2)9-8-10-20(3)23-14-15-24-22-13-12-21-11-6-7-17-26(21,4)25(22)16-18-27(23,24)5/h7,17,19-25H,6,8-16,18H2,1-5H3/t20-,21?,22+,23-,24+,25+,26+,27-/m1/s1
C27H46370.654153033
7827585

6 of 7 defined stereocentres - 6/7 defined
InChI=1/C27H46/c1-19(2)9-8-10-20(3)23-14-15-24-22-13-12-21-11-6-7-17-26(21,4)25(22)16-18-27(23,24)5/h13,19-21,23-25H,6-12,14-18H2,1-5H3/t20-,21?,23-,24+,25+,26+,27-/m1/s1
C27H46370.65415600
7827786

7 of 7 defined stereocentres - 7/7 defined
InChI=1/C27H46/c1-19(2)9-8-10-20(3)23-14-15-24-22-13-12-21-11-6-7-17-26(21,4)25(22)16-18-27(23,24)5/h13,19-21,23-25H,6-12,14-18H2,1-5H3/t20-,21+,23-,24+,25+,26+,27-/m1/s1
C27H46370.65415600
37741

0 of 8 defined stereocentres - 0/8 defined
InChI=1/C27H46/c1-23(2)13-8-15-25(4)21(23)12-16-27(6)22(25)11-10-20-19-9-7-14-24(19,3)17-18-26(20,27)5/h19-22H,7-18H2,1-6H3
C27H46370.65415500
248237

0 of 9 defined stereocentres - 0/9 defined
InChI=1/C27H46/c1-18(2)9-8-10-19(3)20-11-12-21-24-22(13-16-25(20,21)4)26(5)14-6-7-15-27(26)17-23(24)27/h18-24H,6-17H2,1-5H3
C27H46370.65415300
248240

0 of 9 defined stereocentres - 0/9 defined
InChI=1/C27H46/c1-18(2)7-6-8-19(3)22-9-10-23-21-12-16-27-17-20(27)11-15-26(27,5)24(21)13-14-25(22,23)4/h18-24H,6-17H2,1-5H3
C27H46370.65415300
257919

Double-bond stereo
InChI=1/C27H46/c1-3-5-7-9-11-13-15-18-22-26(27-24-20-17-21-25-27)23-19-16-14-12-10-8-6-4-2/h17,20-22,24-25H,3-16,18-19,23H2,1-2H3
C27H46370.65415200
7827787

7 of 7 defined stereocentres - 7/7 defined
InChI=1/C27H46/c1-19(2)9-8-10-20(3)23-14-15-24-22-13-12-21-11-6-7-17-26(21,4)25(22)16-18-27(23,24)5/h13,19-21,23-25H,6-12,14-18H2,1-5H3/t20-,21-,23-,24+,25+,26+,27-/m1/s1
C27H46370.65414510
123

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