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(E)-4-(1-Cyanoprop-1-en-2-yl)benzonitrile

View entire compound with spectra: 1 MS (GC)

(E)-4-(1-Cyanoprop-1-en-2-yl)benzonitrile
SpectraBase Compound ID A7ZLV5qpjDA
InChI InChI=1S/C11H8N2/c1-9(6-7-12)11-4-2-10(8-13)3-5-11/h2-6H,1H3/b9-6+
InChIKey IMJLDOYHYBDGEC-RMKNXTFCSA-N
Mol Weight 168.2 g/mol
Molecular Formula C11H8N2
Exact Mass 168.068748 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID LO2fAWFJwug
Name (E)-4-(1-Cyanoprop-1-en-2-yl)benzonitrile
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C11H8N2
InChI InChI=1S/C11H8N2/c1-9(6-7-12)11-4-2-10(8-13)3-5-11/h2-6H,1H3/b9-6+
InChIKey IMJLDOYHYBDGEC-RMKNXTFCSA-N
Literature Reference DOI 10.1002/anie.201402053
Molecular Weight 168.199 g/mol
SMILES c1c(ccc(\C(=C\C#N)C)c1)C#N
SPLASH splash10-014l-0900000000-47c0faa500a395c886f8
Source of Spectrum ACI-53-SM35-3v
Wiley ID 1782477