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p-(2-OXO-2H-1-BENZOPYRAN-3-YL)BENZONITRILE
SpectraBase Compound ID A1Ew1mr0bqC
InChI InChI=1S/C16H9NO2/c17-10-11-5-7-12(8-6-11)14-9-13-3-1-2-4-15(13)19-16(14)18/h1-9H
InChIKey XFCPTTLANRGAAB-UHFFFAOYSA-N
Mol Weight 247.25 g/mol
Molecular Formula C16H9NO2
Exact Mass 247.063329 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 1Vxo1i9iwvL
Name 3-(4-Cyanophenyl)-2H-chromen-2-one
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C16H9NO2
InChI InChI=1S/C16H9NO2/c17-10-11-5-7-12(8-6-11)14-9-13-3-1-2-4-15(13)19-16(14)18/h1-9H
InChIKey XFCPTTLANRGAAB-UHFFFAOYSA-N
Molecular Weight 247.253 g/mol
SMILES C=1(C(Oc2c(C1)cccc2)=O)c1ccc(C#N)cc1
SPLASH splash10-00ke-1490000000-7e8508210bca18df2e3c
Source of Spectrum KC-0-481-3
Synonyms 4-(2-oxo-2H-chromen-3-yl)benzonitrile 4-(2-oxo-1-benzopyran-3-yl)benzonitrile 4-(2-oxochromen-3-yl)benzonitrile 4-(2-oxidanylidenechromen-3-yl)benzenecarbonitrile
Wiley ID 824176