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3-Methyl-3-phenyl-butyronitrile

View entire compound with spectra: 2 NMR, 1 FTIR, 1 Raman, and 4 MS (GC)

3-Methyl-3-phenyl-butyronitrile
SpectraBase Compound ID 1POJV1KOgL1
InChI InChI=1S/C11H13N/c1-11(2,8-9-12)10-6-4-3-5-7-10/h3-7H,8H2,1-2H3
InChIKey GDMNROWUYDCXRE-UHFFFAOYSA-N
Mol Weight 159.23 g/mol
Molecular Formula C11H13N
Exact Mass 159.104799 g/mol

Transmission Infrared (IR) Spectrum

Transmission Infrared (IR) Spectrum

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SpectraBase Spectrum ID 6httZtdwFxH
Name beta,beta-DIMETHYLHYDROCINNAMONITRILE
Source of Sample F. PROUT, DEPAUL UNIVERSITY, CHICAGO, ILLINOIS
Boiling Point 146C/20mm
Copyright Copyright © 1980, 1981-2025 John Wiley & Sons, Inc. All Rights Reserved.
Formula C11H13N
InChI InChI=1S/C11H13N/c1-11(2,8-9-12)10-6-4-3-5-7-10/h3-7H,8H2,1-2H3
InChIKey GDMNROWUYDCXRE-UHFFFAOYSA-N
Literature Reference J. AM. CHEM. SOC. 74, 5915(1952)
Molecular Weight 159.231995
Synonyms HYDROCINNAMONITRILE, B,B-DIMETHYL-, BUTYRONITRILE, 3-METHYL-3-PHENYL-,
Technique CAPILLARY CELL: NEAT