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(E)-1.beta.-Methoxy-4,4-dimethyl-5-.alpha.-cholestan-3-one oxime
SpectraBase Compound ID HCP7TRo2Ou0
InChI InChI=1S/C30H53NO2/c1-19(2)10-9-11-20(3)22-13-14-23-21-12-15-25-28(4,5)26(31-32)18-27(33-8)30(25,7)24(21)16-17-29(22,23)6/h19-25,27,32H,9-18H2,1-8H3/b31-26+/t20-,21+,22-,23+,24+,25+,27-,29-,30-/m1/s1
InChIKey QMEVDICIFAQPJV-CMCXXXKCSA-N
Mol Weight 459.8 g/mol
Molecular Formula C30H53NO2
Exact Mass 459.40763 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID Efo2WfevuOF
Name (E)-1.beta.-Methoxy-4,4-dimethyl-5-.alpha.-cholestan-3-one oxime
Alternate Name(s) (1beta,5alpha)-1-methoxy-4,4-dimethylcholestan-3-one oxime
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C30H53NO2
InChI InChI=1S/C30H53NO2/c1-19(2)10-9-11-20(3)22-13-14-23-21-12-15-25-28(4,5)26(31-32)18-27(33-8)30(25,7)24(21)16-17-29(22,23)6/h19-25,27,32H,9-18H2,1-8H3/b31-26+/t20-,21+,22-,23+,24+,25+,27-,29-,30-/m1/s1
InChIKey QMEVDICIFAQPJV-CMCXXXKCSA-N
Molecular Weight 459.759 g/mol
SMILES O\N=C/1C[C@]([C@]2([C@](C1(C)C)(CC[C@]1([C@@]3(CC[C@@]([C@]3(CC[C@]21[H])C)([C@@](CCCC(C)C)(C)[H])[H])[H])[H])[H])C)(OC)[H]
SPLASH splash10-06vl-7200900000-74d0ae4eea78331a82de
Source of Spectrum KC-1992-432-22
Wiley ID 776124