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2-Methyl-2-phenyl-3-butenenitrile
SpectraBase Compound ID 7Yf0hiE6ldY
InChI InChI=1S/C11H11N/c1-3-11(2,9-12)10-7-5-4-6-8-10/h3-8H,1H2,2H3
InChIKey QPJHDMLMEJIGFT-UHFFFAOYSA-N
Mol Weight 157.22 g/mol
Molecular Formula C11H11N
Exact Mass 157.089149 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID IiBpoALbrG0
Name 2-methyl-2-phenyl-3-butenenitrile
Copyright Copyright © 2020-2025 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 157.089149358 u
Formula C11H11N
InChI InChI=1S/C11H11N/c1-3-11(2,9-12)10-7-5-4-6-8-10/h3-8H,1H2,2H3
InChIKey QPJHDMLMEJIGFT-UHFFFAOYSA-N
Ionization Type EI
Literature Reference DOI 10.1002/chem.201503414
Molecular Weight 157.216 g/mol
Quality 94
Reported Formula C11H11N
SMILES C=CC(C#N)(C)C1=CC=CC=C1
SPLASH splash10-05mo-0900000000-de834cd6c51b781ee38a
Source of Spectrum QE-21-SM13-3aa (DOI: 10.1002/chem.201503414)
Wiley ID 1907489