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3-(3-aminophenyl)-3-oxopropanenitrile
SpectraBase Compound ID D5aHxNS2vpX
InChI InChI=1S/C9H8N2O/c10-5-4-9(12)7-2-1-3-8(11)6-7/h1-3,6H,4,11H2
InChIKey QOYGOPBQZJOKGW-UHFFFAOYSA-N
Mol Weight 160.18 g/mol
Molecular Formula C9H8N2O
Exact Mass 160.063663 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID GkEFn3NSBX4
Name 3-(3-aminophenyl)-3-oxopropanenitrile
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C9H8N2O
InChI InChI=1S/C9H8N2O/c10-5-4-9(12)7-2-1-3-8(11)6-7/h1-3,6H,4,11H2
InChIKey QOYGOPBQZJOKGW-UHFFFAOYSA-N
Molecular Weight 160.176 g/mol
SMILES Nc1cccc(c1)C(=O)CC#N
SPLASH splash10-02ml-9600000000-d0134fff33b2ee0c0133
Source of Spectrum JX-2012-129
Synonyms 3-(3-aminophenyl)-3-oxo-propanenitrile 3-(3-aminophenyl)-3-oxidanylidene-propanenitrile
Wiley ID 1660576