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1-(4-Butoxyphenyl)-4-(4-cyanophenyl)buta-1,3-diene
SpectraBase Compound ID 5egnTmTYper
InChI InChI=1S/C21H21NO/c1-2-3-16-23-21-14-12-19(13-15-21)7-5-4-6-18-8-10-20(17-22)11-9-18/h4-15H,2-3,16H2,1H3/b6-4+,7-5+
InChIKey VOBSUAZUPQJUHA-YDFGWWAZSA-N
Mol Weight 303.41 g/mol
Molecular Formula C21H21NO
Exact Mass 303.162314 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID DGwriqGVjAB
Name 1-(4-Butoxyphenyl)-4-(4-cyanophenyl)buta-1,3-diene
Alternate Name(s) 4-[(1E,3E)-4-(4-butoxyphenyl)-1,3-butadienyl]benzonitrile
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C21H21NO
InChI InChI=1S/C21H21NO/c1-2-3-16-23-21-14-12-19(13-15-21)7-5-4-6-18-8-10-20(17-22)11-9-18/h4-15H,2-3,16H2,1H3/b6-4+,7-5+
InChIKey VOBSUAZUPQJUHA-YDFGWWAZSA-N
Molecular Weight 303.405 g/mol
SMILES c1(\C=C\C=C\c2ccc(cc2)OCCCC)ccc(cc1)C#N
SPLASH splash10-0uea-0096000000-3b8fb21c395f66bd3971
Source of Spectrum KC-1993-779-0
Wiley ID 779161