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(2RS,2(1RS),3RS)-3-Hexyl-2-(1-hydroxy-1-phenylmethyl)cyclohexan-1-one
SpectraBase Compound ID Eb21gXVNQ6K
InChI InChI=1S/C19H28O2/c1-2-3-4-6-10-15-13-9-14-17(20)18(15)19(21)16-11-7-5-8-12-16/h5,7-8,11-12,15,18-19,21H,2-4,6,9-10,13-14H2,1H3/t15-,18+,19+/m1/s1
InChIKey AHHUWBOHBFHEHE-MNEFBYGVSA-N
Mol Weight 288.43 g/mol
Molecular Formula C19H28O2
Exact Mass 288.20893 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 1GwEpdM0lWx
Name (2RS,2(1RS),3RS)-3-Hexyl-2-(1-hydroxy-1-phenylmethyl)cyclohexan-1-one
Alternate Name(s) (2RS,2(1SR),3RS)-3-Hexyl-2-(1-hydroxy-1-phenylmethyl)cyclohexan-1-one (2RS,2(1SR),3SR)-3-Hexyl-2-(1-hydroxy-1-phenylmethyl)cyclohexan-1-one 3-Hexyl-2-[hydroxy(phenyl)methyl]cyclohexanone
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C19H28O2
InChI InChI=1S/C19H28O2/c1-2-3-4-6-10-15-13-9-14-17(20)18(15)19(21)16-11-7-5-8-12-16/h5,7-8,11-12,15,18-19,21H,2-4,6,9-10,13-14H2,1H3/t15-,18+,19+/m1/s1
InChIKey AHHUWBOHBFHEHE-MNEFBYGVSA-N
Molecular Weight 288.431 g/mol
SMILES O[C@]([C@@]1(C(=O)CCC[C@]1(CCCCCC)[H])[H])(c1ccccc1)[H]
SPLASH splash10-052b-9100000000-d796474a23267ca6611e
Source of Spectrum F-50-1951-65
Wiley ID 1292127