| SpectraBase Compound ID | H6lJwdUirHg |
|---|---|
| InChI | InChI=1S/C26H38O/c1-17(2)6-5-7-18(3)24-12-13-25-23-10-8-19-16-20(27)9-11-21(19)22(23)14-15-26(24,25)4/h5,7,9,11,16-18,22-25,27H,6,8,10,12-15H2,1-4H3/b7-5+/t18-,22-,23-,24-,25+,26-/m1/s1 |
| InChIKey | OBWGUKUMNJWSCT-VBDYUURPSA-N |
| Mol Weight | 366.6 g/mol |
| Molecular Formula | C26H38O |
| Exact Mass | 366.292266 g/mol |
Mass Spectrum (GC)
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| SpectraBase Spectrum ID | KMdVrPfWGnT |
|---|---|
| Name | (22E)-19-Norcholesta-1,3,5(10),22-tetraen-3-ol |
| Appearance | White powder |
| Copyright | Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula | C26H38O |
| InChI | InChI=1S/C26H38O/c1-17(2)6-5-7-18(3)24-12-13-25-23-10-8-19-16-20(27)9-11-21(19)22(23)14-15-26(24,25)4/h5,7,9,11,16-18,22-25,27H,6,8,10,12-15H2,1-4H3/b7-5+/t18-,22-,23-,24-,25+,26-/m1/s1 |
| InChIKey | OBWGUKUMNJWSCT-VBDYUURPSA-N |
| Instrument Name | Finnigan-MAT-95 |
| Ionization Type | EI |
| Literature Reference DOI | 10.1021/np100562n |
| Molecular Weight | 366.589 g/mol |
| Optical Rotation | [a]D24 = +51.6 (c = 0.16, CHCl3) |
| Reported Formula | C26H38O |
| SMILES | Oc1ccc2c(c1)CC[C@@]1([C@@]2(CC[C@]2([C@]1(CC[C@]2([H])[C@](C)(\C=C\CC(C)C)[H])[H])C)[H])[H] |
| SPLASH | splash10-067i-9732000000-82f71386d598fd373e86 |
| Source of Spectrum | G4-74-178-2 |
| Wiley ID | 1849034 |