| SpectraBase Compound ID | DzJUFZQk5El |
|---|---|
| InChI | InChI=1S/C30H50OS/c1-20(2)8-7-9-21(3)26-14-15-27-25-13-12-24-11-10-23(19-32-22(4)31)18-30(24,6)28(25)16-17-29(26,27)5/h10,20-21,24-28H,7-9,11-19H2,1-6H3 |
| InChIKey | VFWCTYXSVGECFG-UHFFFAOYSA-N |
| Mol Weight | 458.8 g/mol |
| Molecular Formula | C30H50OS |
| Exact Mass | 458.358237 g/mol |
Mass Spectrum (GC)
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| SpectraBase Spectrum ID | 6FaLOyC7iE8 |
|---|---|
| Name | Cholest-2-ene-2-methanethiol, acetate, (5.alpha.)- |
| Alternate Name(s) | S-(Cholest-2-en-2-ylmethyl) ethanethioate Ethanethioic acid S-[[10,13-dimethyl-17-(6-methylheptan-2-yl)-4,5,6,7,8,9,11,12,14,15,16,17-dodecahydro-1H-cyclopenta[a]phenanthren-2-yl]methyl] ester S-[[17-(1,5-dimethylhexyl)-10,13-dimethyl-4,5,6,7,8,9,11,12,14,15,16,17-dodecahydro-1H-cyclopenta[a]phenanthren-2-yl]methyl] ethanethioate S-[[10,13-dimethyl-17-(6-methylheptan-2-yl)-4,5,6,7,8,9,11,12,14,15,16,17-dodecahydro-1H-cyclopenta[a]phenanthren-2-yl]methyl] ethanethioate |
| CAS Registry Number | 55283-36-8 |
| Copyright | Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula | C30H50OS |
| InChI | InChI=1S/C30H50OS/c1-20(2)8-7-9-21(3)26-14-15-27-25-13-12-24-11-10-23(19-32-22(4)31)18-30(24,6)28(25)16-17-29(26,27)5/h10,20-21,24-28H,7-9,11-19H2,1-6H3 |
| InChIKey | VFWCTYXSVGECFG-UHFFFAOYSA-N |
| Molecular Weight | 458.789 g/mol |
| SMILES | CC12C3C(C4C(CC3)(C)C(C(CCCC(C)C)C)CC4)CCC2CC=C(C1)CSC(C)=O |
| SPLASH | splash10-00lr-8975100000-7f81c40e40f724360f70 |
| Source of Spectrum | SD-1981-0-0 |
| Wiley ID | 61193 |