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3-Pyridineacetonitrile, .alpha.-[[(2-cyano-1-phenylethenyl)oxy]phenylmethylene]-2,6-dimethyl- , (E,E)-
SpectraBase Compound ID 8KLB0MFJrRb
InChI InChI=1S/C25H19N3O/c1-18-13-14-22(19(2)28-18)23(17-27)25(21-11-7-4-8-12-21)29-24(15-16-26)20-9-5-3-6-10-20/h3-15H,1-2H3/b24-15+,25-23-
InChIKey IHWCLOMPIYGCSN-UXOTVQNASA-N
Mol Weight 377.45 g/mol
Molecular Formula C25H19N3O
Exact Mass 377.152812 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID HBpI7W5sFQc
Name 3-Pyridineacetonitrile, .alpha.-[[(2-cyano-1-phenylethenyl)oxy]phenylmethylene]-2,6-dimethyl- , (E,E)-
Alternate Name(s) (2E)-3-{[(E)-2-cyano-1-phenylethenyl]oxy}-2-(2,6-dimethyl-3-pyridinyl)-3-phenyl-2-propenenitrile 1,1'-Diphenyl-2,2'-dicyano-2-(2,6-dimethyl-3-pyridyl)divinyl ether
CAS Registry Number 61095-48-5
Comments Less than 3 mono-isotopic peaks
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C25H19N3O
InChI InChI=1S/C25H19N3O/c1-18-13-14-22(19(2)28-18)23(17-27)25(21-11-7-4-8-12-21)29-24(15-16-26)20-9-5-3-6-10-20/h3-15H,1-2H3/b24-15+,25-23-
InChIKey IHWCLOMPIYGCSN-UXOTVQNASA-N
Molecular Weight 377.447 g/mol
SMILES C(\C=C/(O\C(=C/(c1c(nc(cc1)C)C)C#N)c1ccccc1)c1ccccc1)#N
SPLASH splash10-0udi-0090000000-2597ce5daad45c90b523
Source of Spectrum C-98-5676-0
Wiley ID 1358364