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3-Cyanopropiophenone
SpectraBase Compound ID FpPUfOcUEH8
InChI InChI=1S/C10H9NO/c1-2-10(12)9-5-3-4-8(6-9)7-11/h3-6H,2H2,1H3
InChIKey RQNDMQXNIOALFA-UHFFFAOYSA-N
Mol Weight 159.19 g/mol
Molecular Formula C10H9NO
Exact Mass 159.068414 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID GzKnTtns2CX
Name 3-Cyanopropiophenone
Alternate Name(s) 4-Keto-4-phenyl-butyronitrile 3-Propionylbenzonitrile 4-Oxidanylidene-4-phenyl-butanenitrile 4-Oxo-4-phenyl-butanenitrile 3-(1-Oxopropyl)benzonitrile 3-Propanoylbenzonitrile 3-Propanoylbenzenecarbonitrile
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Formula C10H9NO
InChI InChI=1S/C10H9NO/c1-2-10(12)9-5-3-4-8(6-9)7-11/h3-6H,2H2,1H3
InChIKey RQNDMQXNIOALFA-UHFFFAOYSA-N
Molecular Weight 159.188 g/mol
SMILES C(#N)c1cc(C(=O)CC)ccc1
SPLASH splash10-001i-0900000000-3ae10e7800e479258df2
Source of Spectrum PS-50-1258-28
Wiley ID 1156295