| SpectraBase Compound ID | 1KmG4p1hVS |
|---|---|
| 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-AHXUEDQKSA-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 | HTwRZ7k9lBe |
|---|---|
| Name | (E)-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-AHXUEDQKSA-N |
| Molecular Weight | 431.705 g/mol |
| SMILES | O\N=C\1C[C@]([C@@]2([C@@]3([C@@]([C@@]4(CC[C@@]([C@]4(CC3)C)([C@@](CCCC(C)C)(C)[H])[H])[H])([H])CC[C@]2(C1)[H])[H])C)(OC)[H] |
| SPLASH | splash10-0089-9003000000-89611897193b8334d05c |
| Source of Spectrum | KC-1992-431-16 |
| Synonyms | (1beta,5alpha)-1-methoxycholestan-3-one oxime |
| Wiley ID | 776131 |