| SpectraBase Compound ID | BBBuzTVufqW |
|---|---|
| InChI | InChI=1S/C30H52O/c1-19(2)9-8-10-21(5)25-13-14-26-23-12-11-22-17-28(31)24(20(3)4)18-30(22,7)27(23)15-16-29(25,26)6/h19-27H,8-18H2,1-7H3 |
| InChIKey | UYBBZZSVXCAUKS-UHFFFAOYSA-N |
| Mol Weight | 428.7 g/mol |
| Molecular Formula | C30H52O |
| Exact Mass | 428.401816 g/mol |
Mass Spectrum (GC)
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| SpectraBase Spectrum ID | IGr36fMQx2Z |
|---|---|
| Name | Cholestan-3-one, 2-(1-methylethyl)-, (2.alpha.,5.alpha.)- |
| Alternate Name(s) | 2-Isopropylcholestan-3-one 10,13-dimethyl-17-(6-methylheptan-2-yl)-2-propan-2-yl-1,2,4,5,6,7,8,9,11,12,14,15,16,17-tetradecahydrocyclopenta[a]phenanthren-3-one 17-(1,5-dimethylhexyl)-2-isopropyl-10,13-dimethyl-1,2,4,5,6,7,8,9,11,12,14,15,16,17-tetradecahydrocyclopenta[a]phenanthren-3-one |
| CAS Registry Number | 55162-60-2 |
| Copyright | Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula | C30H52O |
| InChI | InChI=1S/C30H52O/c1-19(2)9-8-10-21(5)25-13-14-26-23-12-11-22-17-28(31)24(20(3)4)18-30(22,7)27(23)15-16-29(25,26)6/h19-27H,8-18H2,1-7H3 |
| InChIKey | UYBBZZSVXCAUKS-UHFFFAOYSA-N |
| Molecular Weight | 428.745 g/mol |
| SMILES | CC12C3C(C4C(CC3)(C)C(C(CCCC(C)C)C)CC4)CCC2CC(C(C1)C(C)C)=O |
| SPLASH | splash10-052f-9421200000-001f217e82ae8a34f254 |
| Source of Spectrum | SD-1981-0-0 |
| Wiley ID | 59352 |