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2-Pentenoic acid, 2-cyano-4-(4-methylphenyl)-4-phenyl-, methyl ester, (E)-
SpectraBase Compound ID 2IiPMziMLYJ
InChI InChI=1S/C20H19NO2/c1-15-9-11-18(12-10-15)20(2,17-7-5-4-6-8-17)13-16(14-21)19(22)23-3/h4-13H,1-3H3/b16-13+
InChIKey YIRPKDKKCUKBMT-DTQAZKPQSA-N
Mol Weight 305.38 g/mol
Molecular Formula C20H19NO2
Exact Mass 305.141579 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID Ge2vkgPRDeS
Name 2-Pentenoic acid, 2-cyano-4-(4-methylphenyl)-4-phenyl-, methyl ester, (E)-
Alternate Name(s) Methyl (2E)-2-cyano-4-(4-methylphenyl)-4-phenyl-2-pentenoate
CAS Registry Number 117918-94-2
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C20H19NO2
InChI InChI=1S/C20H19NO2/c1-15-9-11-18(12-10-15)20(2,17-7-5-4-6-8-17)13-16(14-21)19(22)23-3/h4-13H,1-3H3/b16-13+
InChIKey YIRPKDKKCUKBMT-DTQAZKPQSA-N
Molecular Weight 305.377 g/mol
SMILES C(\C=C\(C(=O)OC)C#N)(c1ccc(cc1)C)(c1ccccc1)C
SPLASH splash10-06dj-0091000000-cd6b8c542b3a78d914f4
Source of Spectrum J-54-638-0
Wiley ID 1307485