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3-Methyl-5-phenylpentanenitrile
SpectraBase Compound ID EZ3hDiB3tcW
InChI InChI=1S/C12H15N/c1-11(9-10-13)7-8-12-5-3-2-4-6-12/h2-6,11H,7-9H2,1H3
InChIKey UIHGITHJVWASPE-UHFFFAOYSA-N
Mol Weight 173.26 g/mol
Molecular Formula C12H15N
Exact Mass 173.120449 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 1GYyPpcwA8l
Name 3-Methyl-5-phenylpentanenitrile
Alternate Name(s) 3-Methyl-5-phenyl-valeronitrile
CAS Registry Number 54089-83-7
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C12H15N
InChI InChI=1S/C12H15N/c1-11(9-10-13)7-8-12-5-3-2-4-6-12/h2-6,11H,7-9H2,1H3
InChIKey UIHGITHJVWASPE-UHFFFAOYSA-N
Molecular Weight 173.259 g/mol
SMILES CC(CCc1ccccc1)CC#N
SPLASH splash10-0006-9200000000-e1e695cf7eaa202bb4a3
Source of Spectrum H-79-971-14
Wiley ID 1169987