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METHYL-(3,4-DIMETHYL)-BENZOATE
SpectraBase Compound ID 5NLCizZsGl8
InChI InChI=1S/C10H12O2/c1-7-4-5-9(6-8(7)2)10(11)12-3/h4-6H,1-3H3
InChIKey PTSSKYUSCIALKU-UHFFFAOYSA-N
Mol Weight 164.2 g/mol
Molecular Formula C10H12O2
Exact Mass 164.08373 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 6HbxqM9h8zN
Name Benzoic acid, 3,4-dimethyl-, methyl ester
Alternate Name(s) Methyl 3,4-dimethylbenzoate 3,4-(CH3)3-C6H3-CO2CH3 3,4-Dimethylbenzoic acid methyl ester
CAS Registry Number 38404-42-1
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C10H12O2
InChI InChI=1S/C10H12O2/c1-7-4-5-9(6-8(7)2)10(11)12-3/h4-6H,1-3H3
InChIKey PTSSKYUSCIALKU-UHFFFAOYSA-N
Molecular Weight 164.204 g/mol
SMILES Cc1ccc(cc1C)C(=O)OC
SPLASH splash10-001i-2900000000-db2b4f82c16e73875c2c
Source of Spectrum W5-1989-5130-1
Wiley ID 1160408