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3-Cyano-2-ethoxy-5-formyl-6-[N-4-(o-tolyl)piperazinyl]-4-phenylpyridine
SpectraBase Compound ID DVCIdNUCcc1
InChI InChI=1S/C26H26N4O2/c1-3-32-26-21(17-27)24(20-10-5-4-6-11-20)22(18-31)25(28-26)30-15-13-29(14-16-30)23-12-8-7-9-19(23)2/h4-12,18H,3,13-16H2,1-2H3
InChIKey ZCOHMAMLGKGVAU-UHFFFAOYSA-N
Mol Weight 426.52 g/mol
Molecular Formula C26H26N4O2
Exact Mass 426.205576 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID GBXCoJBn3dk
Name 3-Cyano-2-ethoxy-5-formyl-6-[N-4-(o-tolyl)piperazinyl]-4-phenylpyridine
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C26H26N4O2
InChI InChI=1S/C26H26N4O2/c1-3-32-26-21(17-27)24(20-10-5-4-6-11-20)22(18-31)25(28-26)30-15-13-29(14-16-30)23-12-8-7-9-19(23)2/h4-12,18H,3,13-16H2,1-2H3
InChIKey ZCOHMAMLGKGVAU-UHFFFAOYSA-N
Molecular Weight 426.520 g/mol
SMILES c1(c(c(-c2ccccc2)c(c(n1)OCC)C#N)C=O)N1CCN(CC1)c1c(C)cccc1
SPLASH splash10-0002-0910100000-ad716e96073c38ce0b80
Source of Spectrum H1-36-1341-2
Synonyms 2-Ethoxy-5-formyl-6-[4-(2-methylphenyl)-1-piperazinyl]-4-phenylnicotinonitrile
Wiley ID 755348