SpectraBase Compound ID | 9BoiLBBfIZ7 |
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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-SLQKYHDJSA-N |
Mol Weight | 431.7 g/mol |
Molecular Formula | C28H49NO2 |
Exact Mass | 431.37633 g/mol |
SpectraBase Spectrum ID | A5pDBx09iVI |
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Name | (E) and(Z)-1.alpha.-Methoxy-5.beta.-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-SLQKYHDJSA-N |
Molecular Weight | 431.705 g/mol |
SMILES | O\N=C/1CC([C@@]2(C3C([C@@]4(CC[C@@]([C@]4(CC3)C)([C@@](CCCC(C)C)(C)[H])[H])[H])CC[C@@]2(C1)[H])C)OC |
SPLASH | splash10-05us-8903200000-613e264cb4146dba3bf9 |
Source of Spectrum | KC-1992-3109-16 |
Wiley ID | 777371 |