| SpectraBase Compound ID | Enq4Aufhd4Z |
|---|---|
| InChI | InChI=1S/C27H44O/c1-18(2)7-6-8-19(3)23-11-12-24-22-10-9-20-17-21(28)13-15-26(20,4)25(22)14-16-27(23,24)5/h9-10,18-19,21,23-25,28H,6-8,11-17H2,1-5H3/t19-,21+,23-,24+,25+,26+,27-/m1/s1 |
| InChIKey | UCTLRSWJYQTBFZ-DDPQNLDTSA-N |
| Mol Weight | 384.6 g/mol |
| Molecular Formula | C27H44O |
| Exact Mass | 384.339216 g/mol |
Mass Spectrum (GC)
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| SpectraBase Spectrum ID | 5NBAYunxqYr |
|---|---|
| Name | 7-Dehydrocholesterol |
| Copyright | Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula | C27H44O |
| InChI | InChI=1S/C27H44O/c1-18(2)7-6-8-19(3)23-11-12-24-22-10-9-20-17-21(28)13-15-26(20,4)25(22)14-16-27(23,24)5/h9-10,18-19,21,23-25,28H,6-8,11-17H2,1-5H3/t19-,21+,23-,24+,25+,26+,27-/m1/s1 |
| InChIKey | UCTLRSWJYQTBFZ-DDPQNLDTSA-N |
| Ionization Type | EI |
| Literature Reference DOI | 10.1002/rcm.1290091313 |
| Molecular Weight | 384.648 g/mol |
| SMILES | O[C@@]1(CC2=CC=C3[C@@]4(CC[C@]([C@]4(CC[C@@]3([C@@]2(C)CC1)[H])C)([H])[C@](C)(CCCC(C)C)[H])[H])[H] |
| SPLASH | splash10-0a4i-8912000000-4166bad19aa19fe4ab09 |
| Source of Spectrum | RCM-9-1291-7-DHC |
| Wiley ID | 1837358 |