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(2R,6S)-2,6-diphenylcyclohexanone
SpectraBase Compound ID APDyAzXS02S
InChI InChI=1S/C18H18O/c19-18-16(14-8-3-1-4-9-14)12-7-13-17(18)15-10-5-2-6-11-15/h1-6,8-11,16-17H,7,12-13H2/t16-,17+
InChIKey JHMUMWBKYPMOLI-CALCHBBNSA-N
Mol Weight 250.34 g/mol
Molecular Formula C18H18O
Exact Mass 250.135765 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID WdQzrTttIP
Name (2R,6S)-2,6-diphenylcyclohexanone
CAS Registry Number 20834-02-0
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C18H18O
InChI InChI=1S/C18H18O/c19-18-16(14-8-3-1-4-9-14)12-7-13-17(18)15-10-5-2-6-11-15/h1-6,8-11,16-17H,7,12-13H2/t16-,17+
InChIKey JHMUMWBKYPMOLI-CALCHBBNSA-N
Molecular Weight 250.341 g/mol
SMILES C1([C@](c2ccccc2)(CCC[C@@]1(c1ccccc1)[H])[H])=O
SPLASH splash10-0uyi-1920000000-69fe15a3f621859b3cf5
Source of Spectrum K-121-1030-1
Synonyms (2S,6R)-2,6-diphenyl-1-cyclohexanone (2S,6R)-2,6-diphenylcyclohexan-1-one (2S,6R)-2,6-diphenylcyclohexanone 2,6-Diphenylcyclohexanone
Wiley ID 1254155