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3.beta.-[(Benzyloxycarbonyl)amino]-4,4-dimethyl-5.alpha.-(2'-propenyl)cyclohexan-1-one
SpectraBase Compound ID Gzz1Z5DLHXq
InChI InChI=1S/C19H25NO3/c1-4-8-15-11-16(21)12-17(19(15,2)3)20-18(22)23-13-14-9-6-5-7-10-14/h4-7,9-10,15,17H,1,8,11-13H2,2-3H3,(H,20,22)/t15-,17-/m1/s1
InChIKey DVRKWEPAEQQPMS-NVXWUHKLSA-N
Mol Weight 315.41 g/mol
Molecular Formula C19H25NO3
Exact Mass 315.183444 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 13V6M2JQaW0
Name 3.beta.-[(Benzyloxycarbonyl)amino]-4,4-dimethyl-5.alpha.-(2'-propenyl)cyclohexan-1-one
Alternate Name(s) benzyl (1R,3R)-3-allyl-2,2-dimethyl-5-oxocyclohexylcarbamate
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C19H25NO3
InChI InChI=1S/C19H25NO3/c1-4-8-15-11-16(21)12-17(19(15,2)3)20-18(22)23-13-14-9-6-5-7-10-14/h4-7,9-10,15,17H,1,8,11-13H2,2-3H3,(H,20,22)/t15-,17-/m1/s1
InChIKey DVRKWEPAEQQPMS-NVXWUHKLSA-N
Molecular Weight 315.413 g/mol
SMILES N(C(=O)OCc1ccccc1)[C@]1(C([C@](CC=C)(CC(C1)=O)[H])(C)C)[H]
SPLASH splash10-0006-9430000000-408aae7235349d27b118
Source of Spectrum I-78-930-7
Wiley ID 812713