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2-Cyano-4-phenylcyclopentene-1,3-dione
SpectraBase Compound ID 7lmKJkCFPWf
InChI InChI=1S/C12H7NO2/c13-7-10-11(14)6-9(12(10)15)8-4-2-1-3-5-8/h1-6,10H
InChIKey VJKFOBIGAJIPAG-UHFFFAOYSA-N
Mol Weight 197.19 g/mol
Molecular Formula C12H7NO2
Exact Mass 197.047678 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 3Ilqk0ESbz7
Name 2-Cyano-4-phenylcyclopentene-1,3-dione
Alternate Name(s) 2,5-Dioxo-3-phenyl-3-cyclopentene-1-carbonitrile
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C12H7NO2
InChI InChI=1S/C12H7NO2/c13-7-10-11(14)6-9(12(10)15)8-4-2-1-3-5-8/h1-6,10H
InChIKey VJKFOBIGAJIPAG-UHFFFAOYSA-N
Molecular Weight 197.193 g/mol
SMILES C=1(C(C(C#N)C(C1)=O)=O)c1ccccc1
SPLASH splash10-014i-9200000000-963c1b5a91fe659719b6
Source of Spectrum F-53-6111-32
Wiley ID 801943