| SpectraBase Spectrum ID |
B0dHQYtwl7o |
| Name |
CHOLESTA-3,5-DIEN-7-ONE |
| CAS Registry Number |
567-72-6 |
| Copyright |
Copyright © 2011-2024 Wiley-VCH GmbH. All Rights Reserved. |
| Exact Mass |
382.323565971 u |
| Formula |
C27H42O |
| InChI |
InChI=1S/C27H42O/c1-18(2)9-8-10-19(3)21-12-13-22-25-23(14-16-27(21,22)5)26(4)15-7-6-11-20(26)17-24(25)28/h6,11,17-19,21-23,25H,7-10,12-16H2,1-5H3/t19-,21-,22+,23+,25+,26+,27-/m1/s1 |
| InChIKey |
TTXJJFWWNDJDNR-CZRUWHASSA-N |
| Molecular Weight |
382.632 g/mol |
| Nominal Mass |
382 u |
| Number of Peaks |
294 |
| SMILES |
C=1CC[C@@]2([C@]3(CC[C@@]4([C@](CC[C@]4([C@@]3(C(C=C2C1)=O)[H])[H])([C@@](CCCC(C)C)(C)[H])[H])C)[H])C |
| SPLASH |
splash10-00e9-4912000000-2dd76111f11d0c834d1f |
| Source File Reference |
LMCM-82804-654Q |
| Synonyms |
(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-dien-9-one
17-(1,5-DIMETHYL-HEXYL)-10,13-DIMETHYL-1,2,8,9,10,11,12,13,14,15,16,17-DODECAHYDRO-CYCLOPENTA[A]PHENANTHREN-7-ONE |
| Wiley ID |
8_8303 |
