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4-Benzylcyclohexane-1,3-dione
SpectraBase Compound ID 8Ybr827jb48
InChI InChI=1S/C13H14O2/c14-12-7-6-11(13(15)9-12)8-10-4-2-1-3-5-10/h1-5,11H,6-9H2
InChIKey MWKUZDQNPHIKKD-UHFFFAOYSA-N
Mol Weight 202.25 g/mol
Molecular Formula C13H14O2
Exact Mass 202.09938 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID BvOP2MMJkHn
Name 4-Benzylcyclohexane-1,3-dione
Alternate Name(s) 4-(Phenylmethyl)cyclohexane-1,3-dione 4-Benzylcyclohexane-1,3-quinone
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C13H14O2
InChI InChI=1S/C13H14O2/c14-12-7-6-11(13(15)9-12)8-10-4-2-1-3-5-10/h1-5,11H,6-9H2
InChIKey MWKUZDQNPHIKKD-UHFFFAOYSA-N
Molecular Weight 202.253 g/mol
SMILES C1(CC(C(CC1)Cc1ccccc1)=O)=O
SPLASH splash10-0006-9740000000-e33658bcf91f27910175
Source of Spectrum SO-0-477-2
Wiley ID 1538908