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4-phenylpentanenitrile

View entire compound with spectra: 1 MS (GC)

4-phenylpentanenitrile
SpectraBase Compound ID IossO4UX7VL
InChI InChI=1S/C11H13N/c1-10(6-5-9-12)11-7-3-2-4-8-11/h2-4,7-8,10H,5-6H2,1H3
InChIKey OHJHONYMEXPATE-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 8nCVjBotvKJ
Name 4-phenylpentanenitrile
Appearance Pale yellow oil
Copyright Copyright © 2020-2025 John Wiley & Sons, Inc. All Rights Reserved.
Formula C11H13N
InChI InChI=1S/C11H13N/c1-10(6-5-9-12)11-7-3-2-4-8-11/h2-4,7-8,10H,5-6H2,1H3
InChIKey OHJHONYMEXPATE-UHFFFAOYSA-N
Ionization Type EI
Literature Reference DOI 10.1002/ejoc.201801412
Molecular Weight 159.232 g/mol
SMILES c1(ccccc1)C(CCC#N)C
SPLASH splash10-0a4i-0900000000-f68fb756190551e37234
Source of Spectrum U1-2019-SM11-1h
Wiley ID 1843569