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Methyl (2E,4E)-5-(4-cyanophenyl)-4-(2-hydroxyphenyl)hexa-2,4-dienoate
SpectraBase Compound ID LKNiv14S4X9
InChI InChI=1S/C20H17NO3/c1-14(16-9-7-15(13-21)8-10-16)17(11-12-20(23)24-2)18-5-3-4-6-19(18)22/h3-12,22H,1-2H3/b12-11+,17-14+
InChIKey VCVMCFWOHSEALM-MUIYJVFTSA-N
Mol Weight 319.36 g/mol
Molecular Formula C20H17NO3
Exact Mass 319.120843 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID FP4HY9NUTIt
Name Methyl (2E,4E)-5-(4-cyanophenyl)-4-(2-hydroxyphenyl)hexa-2,4-dienoate
Appearance Yellow solid
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Exact Mass 319.120843408 u
Formula C20H17NO3
InChI InChI=1S/C20H17NO3/c1-14(16-9-7-15(13-21)8-10-16)17(11-12-20(23)24-2)18-5-3-4-6-19(18)22/h3-12,22H,1-2H3/b12-11+,17-14+
InChIKey VCVMCFWOHSEALM-MUIYJVFTSA-N
Instrument Name Finnigan MAT 8200
Ionization Type EI
Literature Reference DOI 10.1002/chem.201803360
Quality 321
Reported Formula C20H17NO3
SMILES OC1=C(\C(\C=C\C(OC)=O)=C/(C)C2=CC=C(C=C2)C#N)C=CC=C1
SPLASH splash10-0g2d-0394000000-46474cb05fe40f87c7c5
Source of Spectrum QE-24-SM8-40f (DOI: 10.1002/chem.201803360)
Wiley ID 1901834