| SpectraBase Spectrum ID |
E31LmUO72F8 |
| Name |
3-OXOCHOLESTAN-2-YL ACETATE |
| Copyright |
Copyright © 2011-2024 Wiley-VCH GmbH. All Rights Reserved. |
| Exact Mass |
444.360345403 u |
| Formula |
C29H48O3 |
| InChI |
InChI=1S/C29H48O3/c1-18(2)8-7-9-19(3)23-12-13-24-22-11-10-21-16-26(31)27(32-20(4)30)17-29(21,6)25(22)14-15-28(23,24)5/h18-19,21-25,27H,7-17H2,1-6H3/t19-,21?,22?,23-,24?,25?,27?,28-,29+/m1/s1 |
| InChIKey |
JRLVDQSYDDODPL-OYFBZXROSA-N |
| Molecular Weight |
444.700 g/mol |
| Nominal Mass |
444 u |
| Number of Peaks |
334 |
| SMILES |
C(C)(=O)OC1C(CC2CCC3C4CC[C@]([C@@](CCCC(C)C)(C)[H])([C@@]4(C)CCC3[C@]2(C1)C)[H])=O |
| SPLASH |
splash10-053u-8952100000-2e3242b89bb97bf5824b |
| Source File Reference |
LMCM-15387-124C |
| Synonyms |
(2S,14R,15R)-2,15-dimethyl-14-[(2R)-6-methylheptan-2-yl]-5-oxotetracyclo[8.7.0.0(2,7).0(11,15)]heptadecan-4-yl acetate
ACETIC ACID 17-(1,5-DIMETHYL-HEXYL)-10,13-DIMETHYL-3-OXO-HEXADECAHYDRO-CYCLOPENTA[A]PHENANTHREN-2-YL ESTER |
| Wiley ID |
8_8457 |
