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p-aminobenzonitrile
SpectraBase Compound ID 7CQR4MAdwoh
InChI InChI=1S/C7H6N2/c8-5-6-1-3-7(9)4-2-6/h1-4H,9H2
InChIKey YBAZINRZQSAIAY-UHFFFAOYSA-N
Mol Weight 118.14 g/mol
Molecular Formula C7H6N2
Exact Mass 118.053098 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID DseLT9Rokqc
Name Benzonitrile, 4-amino-
Alternate Name(s) 1-Amino-4-cyanobenzene 4-Amino-benzonitrile 4-Azanylbenzenecarbonitrile 4-Cyanoaniline Aniline, p-cyano- Benzoic acid,4-amino,nitrile Benzonitrile, p-amino- p-Aminobenzonitrile p-Cyanoaniline AI3-24185 BRN 0774507 EINECS 212-850-1 NSC 7625
CAS Registry Number 873-74-5
Comments Less than 3 mono-isotopic peaks
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Formula C7H6N2
InChI InChI=1S/C7H6N2/c8-5-6-1-3-7(9)4-2-6/h1-4H,9H2
InChIKey YBAZINRZQSAIAY-UHFFFAOYSA-N
Molecular Weight 118.139 g/mol
SMILES Nc1ccc(C#N)cc1
SPLASH splash10-014i-0900000000-2df86e69fe3e7cf51b74
Source of Spectrum F-67-1975-2f
Wiley ID 1685986