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(S,R)-2-Benzyl-3-benzoylcyclohexanone
SpectraBase Compound ID BvsiosU4N76
InChI InChI=1S/C20H20O2/c21-19-13-7-12-17(20(22)16-10-5-2-6-11-16)18(19)14-15-8-3-1-4-9-15/h1-6,8-11,17-18H,7,12-14H2/t17-,18+/m1/s1
InChIKey GSJMXPABHRUZHM-MSOLQXFVSA-N
Mol Weight 292.38 g/mol
Molecular Formula C20H20O2
Exact Mass 292.14633 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID IOh8RQ8lTaZ
Name (S,R)-2-Benzyl-3-benzoylcyclohexanone
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C20H20O2
InChI InChI=1S/C20H20O2/c21-19-13-7-12-17(20(22)16-10-5-2-6-11-16)18(19)14-15-8-3-1-4-9-15/h1-6,8-11,17-18H,7,12-14H2/t17-,18+/m1/s1
InChIKey GSJMXPABHRUZHM-MSOLQXFVSA-N
Molecular Weight 292.378 g/mol
SMILES [C@]1([C@](C(=O)c2ccccc2)(CCCC1=O)[H])(Cc1ccccc1)[H]
SPLASH splash10-000i-2900000000-0e511d2a193a5ee19e5d
Source of Spectrum SO-0-663-5
Synonyms (2S,3R)-3-benzoyl-2-benzylcyclohexanone
Wiley ID 873043