| SpectraBase Spectrum ID |
CG0P8kgE5li |
| Name |
CHOLEST-8(14)-ENE-3,15-DIONE |
| Copyright |
Copyright © 2011-2024 Wiley-VCH GmbH. All Rights Reserved. |
| Exact Mass |
398.318480590 u |
| Formula |
C27H42O2 |
| InChI |
InChI=1S/C27H42O2/c1-17(2)7-6-8-18(3)23-16-24(29)25-21-10-9-19-15-20(28)11-13-26(19,4)22(21)12-14-27(23,25)5/h17-19,22-23H,6-16H2,1-5H3/t18-,19?,22+,23-,26+,27-/m1/s1 |
| InChIKey |
DHPSDYFINYQDKO-TUSGONAHSA-N |
| Molecular Weight |
398.631 g/mol |
| Nominal Mass |
398 u |
| Number of Peaks |
257 |
| SMILES |
C1(CC[C@@]2([C@]3(CC[C@@]4([C@](CC(C4=C3CCC2C1)=O)([C@@](CCCC(C)C)(C)[H])[H])C)[H])C)=O |
| SPLASH |
splash10-000t-5977000000-218e705d8a9893b9b4a8 |
| Source File Reference |
LMCM-69082-010A |
| Source of Spectrum |
Prof. D. Henneberg, MPI f. Kohlenforschung, Muelheim a.d.R., Germany |
| Synonyms |
CHOLEST-8(14)-EN-3,15-DION
(1R,2S,14R,15R)-2,15-dimethyl-14-[(2R)-6-methylheptan-2-yl]tetracyclo[8.7.0.0(2,7).0(11,15)]heptadec-10-ene-5,12-dione |
| Wiley ID |
8_26813 |
