| SpectraBase Spectrum ID |
7MfNXCTctqj |
| Name |
CHOLESTA-3,5-DIENE |
| CAS Registry Number |
747-90-0 |
| Copyright |
Copyright © 2011-2025 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 |
167 |
| 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 |
splash10-052g-8911000000-7c4244de1ef99a68b342 |
| Source File Reference |
LMCM-97691-886Z |
| Source of Spectrum |
Prof. D. Henneberg, MPI f. Kohlenforschung, Muelheim a.d.R., Germany |
| Synonyms |
.DELTA.(SUP3,5)-CHOLESTADIENE
(1S,2R,10S,11S,14R,15R)-2,15-dimethyl-14-[(2R)-6-methylheptan-2-yl]tetracyclo[8.7.0.0(2,7).0(11,15)]heptadeca-5,7-diene |
| Wiley ID |
8_31446 |
