| SpectraBase Compound ID | 2rEszo653nC |
|---|---|
| InChI | InChI=1S/C27H44O2/c1-18(2)9-8-10-19(3)20-12-13-21-25-22(14-16-26(20,21)4)27(5)15-7-6-11-24(27)29-17-23(25)28/h11,18-22,25H,6-10,12-17H2,1-5H3/t19-,20-,21+,22+,25+,26-,27-/m1/s1 |
| InChIKey | IJIGCORADLCVCK-JBGBTGPLSA-N |
| Mol Weight | 400.6 g/mol |
| Molecular Formula | C27H44O2 |
| Exact Mass | 400.334131 g/mol |
Mass Spectrum (GC)
View the Full Spectrum for FREE!
The full spectrum can only be viewed using a FREE account.
| SpectraBase Spectrum ID | CBUFjwYXUed |
|---|---|
| Name | B-Homo-5-oxa-4-cholesten-7-one |
| Copyright | Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula | C27H44O2 |
| InChI | InChI=1S/C27H44O2/c1-18(2)9-8-10-19(3)20-12-13-21-25-22(14-16-26(20,21)4)27(5)15-7-6-11-24(27)29-17-23(25)28/h11,18-22,25H,6-10,12-17H2,1-5H3/t19-,20-,21+,22+,25+,26-,27-/m1/s1 |
| InChIKey | IJIGCORADLCVCK-JBGBTGPLSA-N |
| Molecular Weight | 400.647 g/mol |
| SMILES | [C@@]12([C@]([C@@]3(C(COC=4[C@]([C@]3(CC2)[H])(C)CCCC4)=O)[H])(CC[C@@]1([C@@](CCCC(C)C)(C)[H])[H])[H])C |
| SPLASH | splash10-00e9-0209000000-de0d7192f8b7df63de25 |
| Source of Spectrum | F2-44-845-14 |
| Wiley ID | 1639143 |