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p-Toluic acid, 3,5-dimethylphenyl ester

View entire compound with spectra: 1 NMR, and 1 MS (GC)

p-Toluic acid, 3,5-dimethylphenyl ester
SpectraBase Compound ID IYT1S5cfDTy
InChI InChI=1S/C16H16O2/c1-11-4-6-14(7-5-11)16(17)18-15-9-12(2)8-13(3)10-15/h4-10H,1-3H3
InChIKey UDYNJQBTHMSEBU-UHFFFAOYSA-N
Mol Weight 240.3 g/mol
Molecular Formula C16H16O2
Exact Mass 240.11503 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 60LGwrhi7xj
Name p-Toluic acid, 3,5-dimethylphenyl ester
Copyright Copyright © 2020-2025 John Wiley & Sons, Inc. All Rights Reserved.
Formula C16H16O2
InChI InChI=1S/C16H16O2/c1-11-4-6-14(7-5-11)16(17)18-15-9-12(2)8-13(3)10-15/h4-10H,1-3H3
InChIKey UDYNJQBTHMSEBU-UHFFFAOYSA-N
Molecular Weight 240.302 g/mol
SMILES c1c(ccc(c1)C(Oc1cc(cc(c1)C)C)=O)C
SPLASH splash10-014i-2910000000-e34c4e07b1f17fe53ee2
Source of Spectrum NP-6-5358-0
Synonyms (3,5-dimethylphenyl) 4-methylbenzoate
Wiley ID 1105793