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3-methyl-3-phenylbutyronitrile
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

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 2WiwdUK4yDR
Name 3-Methyl-3-phenylbutanenitrile
Copyright Copyright © 2020-2024 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 DOI 10.1021/acs.joc.6b00116
Molecular Weight 159.232 g/mol
SMILES C(#N)CC(c1ccccc1)(C)C
SPLASH splash10-0abc-5900000000-111011980861bb407bbf
Source of Spectrum J-81-3165-3c
Wiley ID 1804422