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(2E,4E)-2-(N-allylanilino)-2,4-heptadienenitrile
SpectraBase Compound ID FddxLMw7C2
InChI InChI=1S/C16H18N2/c1-3-5-7-12-16(14-17)18(13-4-2)15-10-8-6-9-11-15/h4-12H,2-3,13H2,1H3/b7-5+,16-12+
InChIKey XFEFGSKVBCZMKF-DBVKDMIVSA-N
Mol Weight 238.33 g/mol
Molecular Formula C16H18N2
Exact Mass 238.146999 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 68p4Rvhr51c
Name (2E,4E)-2-(N-allylanilino)-2,4-heptadienenitrile
Alternate Name(s) (2E,4E)-2-(allylanilino)-2,4-heptadienenitrile
CAS Registry Number 117679-46-6
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C16H18N2
InChI InChI=1S/C16H18N2/c1-3-5-7-12-16(14-17)18(13-4-2)15-10-8-6-9-11-15/h4-12H,2-3,13H2,1H3/b7-5+,16-12+
InChIKey XFEFGSKVBCZMKF-DBVKDMIVSA-N
Molecular Weight 238.334 g/mol
SMILES c1(N(\C(C#N)=C/C=C/CC)CC=C)ccccc1
SPLASH splash10-002b-4940000000-13f8abd2b17ffe6cb357
Source of Spectrum J-54-482-5
Wiley ID 1241420