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p-Tolylacetonitrile

View entire compound with spectra: 4 NMR, 7 FTIR, 1 Raman, 3 MS (GC), and 2 Near IR

p-Tolylacetonitrile
SpectraBase Compound ID 9DrjW681yG5
InChI InChI=1S/C9H9N/c1-8-2-4-9(5-3-8)6-7-10/h2-5H,6H2,1H3
InChIKey RNHKXHKUKJXLAU-UHFFFAOYSA-N
Mol Weight 131.18 g/mol
Molecular Formula C9H9N
Exact Mass 131.073499 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID CKpZtTpaGux
Name (4-Methylphenyl)acetonitrile
CAS Registry Number 2947-61-7
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C9H9N
InChI InChI=1S/C9H9N/c1-8-2-4-9(5-3-8)6-7-10/h2-5H,6H2,1H3
InChIKey RNHKXHKUKJXLAU-UHFFFAOYSA-N
Molecular Weight 131.178 g/mol
SMILES C(#N)Cc1ccc(cc1)C
SPLASH splash10-0fr6-4900000000-3b164c047b8bc408f39c
Source of Spectrum SK-20-3132-4
Synonyms Benzeneacetonitrile, 4-methyl- 4-Methylphenylacetonitrile 4-Methylbenzyl cyanide 2-(p-tolyl)acetonitrile 4-Tolylacetonitrile 2-(4-Methylphenyl)acetonitrile p-Methylbenzyl cyanide 2-(4-Methylphenyl)ethanenitrile p-Methylphenylacetonitrile p-Tolylacetonitrile p-Xylyl cyanide
Wiley ID 851624