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2-Methyl-1-(phenylpropylidene)-propanedinitrile

View entire compound with spectra: 1 NMR, 1 FTIR, and 1 MS (GC)

2-Methyl-1-(phenylpropylidene)-propanedinitrile
SpectraBase Compound ID HAZgKRR4QJ4
InChI InChI=1S/C13H12N2/c1-10(2)13(12(8-14)9-15)11-6-4-3-5-7-11/h3-7,10H,1-2H3
InChIKey DRPVOBCVQXUGIE-UHFFFAOYSA-N
Mol Weight 196.25 g/mol
Molecular Formula C13H12N2
Exact Mass 196.100048 g/mol

Vapor Phase (Gas) Infrared Spectrum

Vapor Phase (Gas) Infrared Spectrum

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SpectraBase Spectrum ID 7ddJp6mvo3z
Name 2-Methyl-1-(phenylpropylidene)-propanedinitrile
Comments Computed using SmartSpectra Model v1.42
Copyright Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 196.100048394 u
Formula C13H12N2
InChI InChI=1S/C13H12N2/c1-10(2)13(12(8-14)9-15)11-6-4-3-5-7-11/h3-7,10H,1-2H3
InChIKey DRPVOBCVQXUGIE-UHFFFAOYSA-N
Molecular Weight 196.253 g/mol
SMILES C(=C(C1=CC=CC=C1)C(C)C)(C#N)C#N
Spectrum/Structure Validation Score (Vapor Phase IR) 0.853323