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.alpha.,4-Dicyanotoluene
SpectraBase Compound ID BIfsdvrxbe1
InChI InChI=1S/C9H6N2/c10-6-5-8-1-3-9(7-11)4-2-8/h1-4H,5H2
InChIKey QILKKAFYAFEWGU-UHFFFAOYSA-N
Mol Weight 142.16 g/mol
Molecular Formula C9H6N2
Exact Mass 142.053098 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 8fDGgJHAuhK
Name .alpha.,4-Dicyanotoluene
Alternate Name(s) Benzeneacetonitrile, 4-cyano- 4-(Cyanomethyl)benzonitrile .alpha.-Cyano-p-tolunitrile 4-(Cyanomethyl)benzenecarbonitrile 4-Cyanophenylacetonitrile p-Cyanobenzylcyanide p-Tolunitrile, .alpha.-cyano-
CAS Registry Number 876-31-3
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C9H6N2
InChI InChI=1S/C9H6N2/c10-6-5-8-1-3-9(7-11)4-2-8/h1-4H,5H2
InChIKey QILKKAFYAFEWGU-UHFFFAOYSA-N
Molecular Weight 142.161 g/mol
SMILES C(#N)Cc1ccc(C#N)cc1
SPLASH splash10-0006-4900000000-7088f851f6b18661dd5e
Source of Spectrum OS-5-258-0
Wiley ID 1141406