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2-[[5-cyano-6-ethoxy-4-phenyl-2-(4-piperidinopiperidino)-3-pyridyl]methylene]malononitrile
SpectraBase Compound ID BzXa5FHpE6A
InChI InChI=1S/C28H30N6O/c1-2-35-28-25(20-31)26(22-9-5-3-6-10-22)24(17-21(18-29)19-30)27(32-28)34-15-11-23(12-16-34)33-13-7-4-8-14-33/h3,5-6,9-10,17,23H,2,4,7-8,11-16H2,1H3
InChIKey QCEMNTVWQAOBCO-UHFFFAOYSA-N
Mol Weight 466.59 g/mol
Molecular Formula C28H30N6O
Exact Mass 466.24811 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID CWz0qSEGxUu
Name 2-[[5-cyano-6-ethoxy-4-phenyl-2-(4-piperidinopiperidino)-3-pyridyl]methylene]malononitrile
Alternate Name(s) 2-[[5-cyano-6-ethoxy-4-phenyl-2-[4-(1-piperidinyl)-1-piperidinyl]-3-pyridinyl]methylidene]propanedinitrile 2-[[5-cyano-6-ethoxy-4-phenyl-2-[4-(1-piperidyl)-1-piperidyl]-3-pyridyl]methylene]propanedinitrile
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C28H30N6O
InChI InChI=1S/C28H30N6O/c1-2-35-28-25(20-31)26(22-9-5-3-6-10-22)24(17-21(18-29)19-30)27(32-28)34-15-11-23(12-16-34)33-13-7-4-8-14-33/h3,5-6,9-10,17,23H,2,4,7-8,11-16H2,1H3
InChIKey QCEMNTVWQAOBCO-UHFFFAOYSA-N
Molecular Weight 466.589 g/mol
SMILES c1(nc(OCC)c(c(c1C=C(C#N)C#N)-c1ccccc1)C#N)N1CCC(N2CCCCC2)CC1
SPLASH splash10-00di-0901300000-558f390af98f7f6d7f2a
Source of Spectrum F-49-2697-3
Wiley ID 1392009