SpectraBase Compound ID | 2VyyGSmogLt |
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InChI | InChI=1S/C29H50S2/c1-20(2)9-8-10-21(3)23-12-13-24-22-19-29(30-17-18-31-29)26-11-6-7-15-28(26,5)25(22)14-16-27(23,24)4/h20-26H,6-19H2,1-5H3 |
InChIKey | JDSZAEGZNJDHFY-UHFFFAOYSA-N |
Mol Weight | 462.8 g/mol |
Molecular Formula | C29H50S2 |
Exact Mass | 462.335394 g/mol |
SpectraBase Spectrum ID | 1ropsNDt9qc |
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Name | 5.alpha.-Cholestan-6-one, cyclic ethylene mercaptole |
CAS Registry Number | 17690-27-6 |
Copyright | Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
Formula | C29H50S2 |
InChI | InChI=1S/C29H50S2/c1-20(2)9-8-10-21(3)23-12-13-24-22-19-29(30-17-18-31-29)26-11-6-7-15-28(26,5)25(22)14-16-27(23,24)4/h20-26H,6-19H2,1-5H3 |
InChIKey | JDSZAEGZNJDHFY-UHFFFAOYSA-N |
Molecular Weight | 462.839 g/mol |
SMILES | CC12C(C3(CC4C2CCC2(C4CCC2C(CCCC(C)C)C)C)SCCS3)CCCC1 |
SPLASH | splash10-0abc-9777000000-2d42893095e1e3065790 |
Source of Spectrum | SD-1981-0-0 |
Synonyms | 10,13-dimethyl-17-(6-methylheptan-2-yl)spiro[1,2,3,4,5,7,8,9,11,12,14,15,16,17-tetradecahydrocyclopenta[a]phenanthrene-6,2'-1,3-dithiolane] 17-(1,5-dimethylhexyl)-10,13-dimethyl-spiro[1,2,3,4,5,7,8,9,11,12,14,15,16,17-tetradecahydrocyclopenta[a]phenanthrene-6,2'-1,3-dithiolane] |
Wiley ID | 1391187 |