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FCYkDYYO1Xj
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FCYkDYYO1Xj
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Cholestane-5-carbonitrile, 3,3-dimethoxy-, (5.beta.)-
SpectraBase Compound ID 8Cc0hH8sP99
InChI InChI=1S/C30H51NO2/c1-21(2)9-8-10-22(3)24-11-12-25-23-13-16-29(20-31)19-30(32-6,33-7)18-17-28(29,5)26(23)14-15-27(24,25)4/h21-26H,8-19H2,1-7H3
InChIKey YURYWLUKQZBVMQ-UHFFFAOYSA-N
Mol Weight 457.7 g/mol
Molecular Formula C30H51NO2
Exact Mass 457.39198 g/mol
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Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID FCYkDYYO1Xj
Name Cholestane-5-carbonitrile, 3,3-dimethoxy-, (5.beta.)-
CAS Registry Number 55282-49-0
Copyright Copyright © 2020-2025 John Wiley & Sons, Inc. All Rights Reserved.
Formula C30H51NO2
InChI InChI=1S/C30H51NO2/c1-21(2)9-8-10-22(3)24-11-12-25-23-13-16-29(20-31)19-30(32-6,33-7)18-17-28(29,5)26(23)14-15-27(24,25)4/h21-26H,8-19H2,1-7H3
InChIKey YURYWLUKQZBVMQ-UHFFFAOYSA-N
Molecular Weight 457.743 g/mol
SMILES C(#N)C12C(C)(C3C(CC2)C2C(CC3)(C)C(C(CCCC(C)C)C)CC2)CCC(C1)(OC)OC
SPLASH splash10-0udi-4900100000-df3e7e4605e9cd0bf448
Source of Spectrum AD-0-5228-0
Synonyms 3,3-Dimethoxycholestane-5-carbonitrile 17-(1,5-dimethylhexyl)-3,3-dimethoxy-10,13-dimethyl-2,4,6,7,8,9,11,12,14,15,16,17-dodecahydro-1H-cyclopenta[a]phenanthrene-5-carbonitrile 3,3-Dimethoxy-10,13-dimethyl-17-(6-methylheptan-2-yl)-2,4,6,7,8,9,11,12,14,15,16,17-dodecahydro-1H-cyclopenta[a]phenanthrene-5-carbonitrile
Wiley ID 1389683
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