| SpectraBase Spectrum ID |
H63ZLVqTWTG |
| Name |
5.beta.-Cholestan-3-one, 2,2-dimethyl- |
| Alternate Name(s) |
Cholestan-3-one, 2,2-dimethyl-, (5.beta.)-
(5beta)-2,2-dimethylcholestan-3-one
2,2-Dimethyl-5.beta.-cholesttan-3-one |
| CAS Registry Number |
24164-69-0 |
| Copyright |
Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula |
C29H50O |
| InChI |
InChI=1S/C29H50O/c1-19(2)9-8-10-20(3)23-13-14-24-22-12-11-21-17-26(30)27(4,5)18-29(21,7)25(22)15-16-28(23,24)6/h19-25H,8-18H2,1-7H3/t20-,21-,22+,23-,24+,25+,28-,29+/m1/s1 |
| InChIKey |
CDCRPVPZAHROEM-YJHSJKDASA-N |
| Molecular Weight |
414.718 g/mol |
| SMILES |
[C@@]12([C@@]3([C@@]([C@@]4(CC[C@@]([C@]4(CC3)C)([C@@](CCCC(C)C)(C)[H])[H])[H])([H])CC[C@@]2(CC(=O)C(C1)(C)C)[H])[H])C |
| SPLASH |
splash10-08gj-0039800000-bbd69cf6bf4b658caf00 |
| Source of Spectrum |
AJ-60-1081-30 |
| Wiley ID |
1375821 |
