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4-Methyl-2-phenyl-4-pentenenitrile
SpectraBase Compound ID 6LsKMqQT1gH
InChI InChI=1S/C12H13N/c1-10(2)8-12(9-13)11-6-4-3-5-7-11/h3-7,12H,1,8H2,2H3
InChIKey GQFRLTAMOZSGLP-UHFFFAOYSA-N
Mol Weight 171.24 g/mol
Molecular Formula C12H13N
Exact Mass 171.104799 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID E8xf20OgTGf
Name 4-Methyl-2-phenyl-4-pentenenitrile
Alternate Name(s) 4-Methyl-2-phenylpent-4-enenitrile
CAS Registry Number 58143-70-7
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C12H13N
InChI InChI=1S/C12H13N/c1-10(2)8-12(9-13)11-6-4-3-5-7-11/h3-7,12H,1,8H2,2H3
InChIKey GQFRLTAMOZSGLP-UHFFFAOYSA-N
Molecular Weight 171.243 g/mol
SMILES C(#N)C(CC(=C)C)c1ccccc1
SPLASH splash10-0a4i-9500000000-e36404a01ae978e3f42f
Source of Spectrum K-125-920-7
Wiley ID 1154252