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(E)-2-(Benzylamino)-4-phenylbut-3-enenitrile
SpectraBase Compound ID 5NYiTvdMP7G
InChI InChI=1S/C17H16N2/c18-13-17(12-11-15-7-3-1-4-8-15)19-14-16-9-5-2-6-10-16/h1-12,17,19H,14H2/b12-11+
InChIKey IEZWSOUGPRZTQK-VAWYXSNFSA-N
Mol Weight 248.33 g/mol
Molecular Formula C17H16N2
Exact Mass 248.131349 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID KuvcmVmTQiG
Name (E)-2-(Benzylamino)-4-phenylbut-3-enenitrile
Appearance Yellow solid
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 248.131348523 u
Formula C17H16N2
InChI InChI=1S/C17H16N2/c18-13-17(12-11-15-7-3-1-4-8-15)19-14-16-9-5-2-6-10-16/h1-12,17,19H,14H2/b12-11+
InChIKey IEZWSOUGPRZTQK-VAWYXSNFSA-N
Instrument Name Finnigan SSQ7000
Ionization Type EI
Literature Reference DOI 10.1002/chem.201603057
Molecular Weight 248.329 g/mol
Quality 229
SMILES N(CC1=CC=CC=C1)C(C#N)\C=C\C1=CC=CC=C1
SPLASH splash10-006x-9550000000-828727585a138940ac07
Source of Spectrum QE-22-SM8-6l (DOI: 10.1002/chem.201603057)
Thin-Layer Chromatography 0.14 (n-pentane/EtOAc, 20:1)
Wiley ID 1905160