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Benzoic acid, 4-methoxy-5-methyl-2-(1-methyl-3-oxo-1-propenyl)-, methyl ester, (E)-
SpectraBase Compound ID DhaIx03ANsB
InChI InChI=1S/C14H16O4/c1-9(5-6-15)11-8-13(17-3)10(2)7-12(11)14(16)18-4/h5-8H,1-4H3/b9-5+
InChIKey QKPBNJLQQVLHQE-WEVVVXLNSA-N
Mol Weight 248.28 g/mol
Molecular Formula C14H16O4
Exact Mass 248.104859 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 83yxsD7DswR
Name Benzoic acid, 4-methoxy-5-methyl-2-(1-methyl-3-oxo-1-propenyl)-, methyl ester, (E)-
CAS Registry Number 101212-40-2
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C14H16O4
InChI InChI=1S/C14H16O4/c1-9(5-6-15)11-8-13(17-3)10(2)7-12(11)14(16)18-4/h5-8H,1-4H3/b9-5+
InChIKey QKPBNJLQQVLHQE-WEVVVXLNSA-N
Molecular Weight 248.278 g/mol
SMILES c1(c(cc(c(c1)C)OC)\C(=C\C=O)C)C(=O)OC
SPLASH splash10-014r-0590000000-60efbff18e3efe82baf1
Source of Spectrum KC-1987-1632-53
Synonyms Methyl 2-[(E)-3-formylprop-2-en-2-yl]-4-methoxy-5-methylbenzoate Methyl 4-methoxy-5-methyl-2-[(1E)-1-methyl-3-oxo-1-propenyl]benzoate
Wiley ID 1251075