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(Z)-3-methyl-5-phenylpent-2-enenitrile
SpectraBase Compound ID B2Y2ceHbY6n
InChI InChI=1S/C12H13N/c1-11(9-10-13)7-8-12-5-3-2-4-6-12/h2-6,9H,7-8H2,1H3/b11-9-
InChIKey QELCXXZZKSRBET-LUAWRHEFSA-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 JuMeTAw5NJp
Name (Z)-3-methyl-5-phenylpent-2-enenitrile
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C12H13N
InChI InChI=1S/C12H13N/c1-11(9-10-13)7-8-12-5-3-2-4-6-12/h2-6,9H,7-8H2,1H3/b11-9-
InChIKey QELCXXZZKSRBET-LUAWRHEFSA-N
Literature Reference DOI 10.1002/anie.201402053
Molecular Weight 171.243 g/mol
SMILES c1(ccccc1)CC\C(=C/C#N)C
SPLASH splash10-0006-9100000000-47105aaa12310d8130f4
Source of Spectrum ACI-53-SM28-3r
Wiley ID 1782473