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Cyclohexanone, 2-(2-oxo-1-phenylpropyl)-, (R*,S*)-
SpectraBase Compound ID 7TXXMLWUJIZ
InChI InChI=1S/C15H18O2/c1-11(16)15(12-7-3-2-4-8-12)13-9-5-6-10-14(13)17/h2-4,7-8,13,15H,5-6,9-10H2,1H3/t13?,15-/m0/s1
InChIKey BWUXTIYMYUWCTG-WUJWULDRSA-N
Mol Weight 230.31 g/mol
Molecular Formula C15H18O2
Exact Mass 230.13068 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 9UgqxCSa3My
Name Cyclohexanone, 2-(2-oxo-1-phenylpropyl)-, (R*,S*)-
Alternate Name(s) (1R*,2S*)-1-(2-oxo-cyclohexyl)-1-phenyl-2-propanone 2-[(1R)-2-oxo-1-phenylpropyl]cyclohexanone
CAS Registry Number 126890-26-4
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C15H18O2
InChI InChI=1S/C15H18O2/c1-11(16)15(12-7-3-2-4-8-12)13-9-5-6-10-14(13)17/h2-4,7-8,13,15H,5-6,9-10H2,1H3/t13?,15-/m0/s1
InChIKey BWUXTIYMYUWCTG-WUJWULDRSA-N
Molecular Weight 230.307 g/mol
SMILES C1([C@@](C(=O)C)(c2ccccc2)[H])C(=O)CCCC1
SPLASH splash10-0006-9600000000-14a33f2a9942c5e86b54
Source of Spectrum F-45-5678-0
Wiley ID 1232192