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Benzenepropanoic acid, .beta.,2,4-trimethyl-, methyl ester
SpectraBase Compound ID 8EVNCryKz3H
InChI InChI=1S/C13H18O2/c1-9-5-6-12(10(2)7-9)11(3)8-13(14)15-4/h5-7,11H,8H2,1-4H3
InChIKey MJURPCRCZXEIPE-UHFFFAOYSA-N
Mol Weight 206.28 g/mol
Molecular Formula C13H18O2
Exact Mass 206.13068 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 6cUlVLbzH6O
Name Benzenepropanoic acid, .beta.,2,4-trimethyl-, methyl ester
CAS Registry Number 56298-76-1
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C13H18O2
InChI InChI=1S/C13H18O2/c1-9-5-6-12(10(2)7-9)11(3)8-13(14)15-4/h5-7,11H,8H2,1-4H3
InChIKey MJURPCRCZXEIPE-UHFFFAOYSA-N
Molecular Weight 206.285 g/mol
SMILES C(CC(C)c1c(cc(cc1)C)C)(=O)OC
SPLASH splash10-001i-2910000000-6b89b5868161533196a0
Source of Spectrum JX-2015-6-8618
Synonyms Methyl 3-(2,4-dimethylphenyl)butanoate 3-(2,4-dimethylphenyl)butanoic acid methyl ester 3-(2,4-dimethylphenyl)butyric acid methyl ester Methyl 3-(2,4-xylyl)butanoate
Wiley ID 1729996