| SpectraBase Compound ID | 8jkaLGGpZ6f |
|---|---|
| InChI | InChI=1S/C28H49NO2/c1-18(2)8-7-9-19(3)23-12-13-24-22-11-10-20-16-21(29-30)17-26(31-6)28(20,5)25(22)14-15-27(23,24)4/h18-20,22-26,30H,7-17H2,1-6H3/b29-21-/t19-,20+,22+,23-,24+,25+,26-,27-,28+/m1/s1 |
| InChIKey | XJUUNTYFYPNKDG-UDICPKBPSA-N |
| Mol Weight | 431.7 g/mol |
| Molecular Formula | C28H49NO2 |
| Exact Mass | 431.37633 g/mol |
Mass Spectrum (GC)
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| SpectraBase Spectrum ID | 4jfo4s4BSI9 |
|---|---|
| Name | (Z)-1.beta.-Methoxy-5.alpha.-cholestan-3-one oxime |
| Copyright | Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula | C28H49NO2 |
| InChI | InChI=1S/C28H49NO2/c1-18(2)8-7-9-19(3)23-12-13-24-22-11-10-20-16-21(29-30)17-26(31-6)28(20,5)25(22)14-15-27(23,24)4/h18-20,22-26,30H,7-17H2,1-6H3/b29-21-/t19-,20+,22+,23-,24+,25+,26-,27-,28+/m1/s1 |
| InChIKey | XJUUNTYFYPNKDG-UDICPKBPSA-N |
| Molecular Weight | 431.705 g/mol |
| SMILES | O\N=C/1C[C@]([C@]2([C@](C1)(CC[C@]1([C@@]3(CC[C@]([C@@](CCCC(C)C)(C)[H])([C@@]3(C)CC[C@]21[H])[H])[H])[H])[H])C)(OC)[H] |
| SPLASH | splash10-0089-9003000000-2a5d04691fe8d35cd277 |
| Source of Spectrum | KC-1992-431-15 |
| Synonyms | (1beta,5alpha)-1-methoxycholestan-3-one oxime |
| Wiley ID | 776132 |