| SpectraBase Spectrum ID |
3PHsnVgB8Zm |
| Name |
1-(3-OXOCHOLESTAN-2-YL)ETHANONE |
| Copyright |
Copyright © 2011-2024 Wiley-VCH GmbH. All Rights Reserved. |
| Exact Mass |
428.365430784 u |
| Formula |
C29H48O2 |
| InChI |
InChI=1S/C29H48O2/c1-18(2)8-7-9-19(3)24-12-13-25-22-11-10-21-16-27(31)23(20(4)30)17-29(21,6)26(22)14-15-28(24,25)5/h18-19,21-26H,7-17H2,1-6H3/t19-,21?,22?,23?,24-,25?,26?,28-,29+/m1/s1 |
| InChIKey |
HMIXBGXWPXVIHK-FRMSUJNNSA-N |
| Molecular Weight |
428.701 g/mol |
| Nominal Mass |
428 u |
| Number of Peaks |
305 |
| SMILES |
C(C)(C1C(CC2CCC3C4CC[C@]([C@@](CCCC(C)C)(C)[H])([C@@]4(C)CCC3[C@]2(C1)C)[H])=O)=O |
| SPLASH |
splash10-054o-9721200000-9055ff2e25dff6719c48 |
| Source File Reference |
LMCM-52144-915S |
| Synonyms |
(2S,14R,15R)-4-acetyl-2,15-dimethyl-14-[(2R)-6-methylheptan-2-yl]tetracyclo[8.7.0.0(2,7).0(11,15)]heptadecan-5-one
17-(1,5-DIMETHYL-HEXYL)-2-(1-HYDROXY-ETHYLIDENE)-10,13-DIMETHYL-HEXADECAHYDRO-CYCLOPENTA[A]PHENANTHREN-3-ONE |
| Wiley ID |
8_8267 |
