| SpectraBase Spectrum ID |
Lv63frbudc3 |
| Name |
CHOLESTA-3,5-DIENE |
| CAS Registry Number |
747-90-0 |
| Copyright |
Copyright © 2011-2024 Wiley-VCH GmbH. All Rights Reserved. |
| Exact Mass |
368.344301417 u |
| Formula |
C27H44 |
| InChI |
InChI=1S/C27H44/c1-19(2)9-8-10-20(3)23-14-15-24-22-13-12-21-11-6-7-17-26(21,4)25(22)16-18-27(23,24)5/h6,11-12,19-20,22-25H,7-10,13-18H2,1-5H3/t20-,22+,23-,24+,25+,26+,27-/m1/s1 |
| InChIKey |
RLHIRZFWJBOHHD-HKQCOZBKSA-N |
| Molecular Weight |
368.649 g/mol |
| Nominal Mass |
368 u |
| Number of Peaks |
82 |
| SMILES |
C=1CC[C@@]2([C@]3(CC[C@@]4([C@](CC[C@]4([C@@]3(CC=C2C1)[H])[H])([C@@](CCCC(C)C)(C)[H])[H])C)[H])C |
| SPLASH |
splash10-014i-9726000000-5a9bd0d4ea9d3a988328 |
| Source File Reference |
LMCM-35260-728W |
| Source of Spectrum |
Prof. Spiteller, University Bayreuth, Germany |
| Synonyms |
CHOLEST-3,5-DIENE
(8S,9S,10R,13R,14S,17R)-10,13-dimethyl-17-((R)-6-methylheptan-2-yl)-2,7,8,9,10,11,12,13,14,15,16,17-dodecahydro-1H-cyclopenta[a]phenanthrene |
| Wiley ID |
4_584 |
