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2,4-Hexadienoic acid, 4-methylphenyl ester
SpectraBase Compound ID JT1Z1wCPr6j
InChI InChI=1S/C13H14O2/c1-3-4-5-6-13(14)15-12-9-7-11(2)8-10-12/h3-10H,1-2H3/b4-3+,6-5+
InChIKey PHJBAQCHWVWSDF-VNKDHWASSA-N
Mol Weight 202.25 g/mol
Molecular Formula C13H14O2
Exact Mass 202.09938 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 9R18rAdwM7t
Name 2,4-Hexadienoic acid, 4-methylphenyl ester
Alternate Name(s) 4-Methylphenyl (2E,4E)-2,4-hexadienoate (2E,4E)-hexa-2,4-dienoic acid (4-methylphenyl) ester (2E,4E)-hexa-2,4-dienoic acid p-tolyl ester (4-methylphenyl) (2E,4E)-hexa-2,4-dienoate p-Tolyl (2E,4E)-hexa-2,4-dienoate
CAS Registry Number 69687-90-7
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C13H14O2
InChI InChI=1S/C13H14O2/c1-3-4-5-6-13(14)15-12-9-7-11(2)8-10-12/h3-10H,1-2H3/b4-3+,6-5+
InChIKey PHJBAQCHWVWSDF-VNKDHWASSA-N
Molecular Weight 202.253 g/mol
SMILES C\C=C\C=C\C(=O)Oc1ccc(C)cc1
SPLASH splash10-0002-9000000000-b99484b551decd540b41
Source of Spectrum W5-15733-0-0
Wiley ID 1200003