| SpectraBase Compound ID | LCzViXTOnj8 |
|---|---|
| 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/h9,18,21-22,24-25,28H,6-8,10-17H2,1-5H3/b23-19-/t21-,22-,24-,25-,26-,27+/m0/s1 |
| InChIKey | MFLHEVKHIWSJOA-MBMUVKMBSA-N |
| Mol Weight | 384.6 g/mol |
| Molecular Formula | C27H44O |
| Exact Mass | 384.339216 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
View the Full Spectrum for FREE!
The full spectrum can only be viewed using a FREE account.
| SpectraBase Spectrum ID | HKTjHJHunGk |
|---|---|
| Name | (Z)-3.beta.-Hydroxycholesta-5,17(20)-diene |
| Comments | Computed using HOSE algorithm |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 384.339216036 u |
| 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/h9,18,21-22,24-25,28H,6-8,10-17H2,1-5H3/b23-19-/t21-,22-,24-,25-,26-,27+/m0/s1 |
| InChIKey | MFLHEVKHIWSJOA-MBMUVKMBSA-N |
| Molecular Weight | 384.648 g/mol |
| SMILES | [C@@]12(\C(CC[C@]2([C@@]2(CC=C3[C@@]([C@]2(CC1)[H])(CC[C@](O)(C3)[H])C)[H])[H])=C/(CCCC(C)C)C)C |