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METHYL-(2,4-DIMETHYL)-BENZOATE
SpectraBase Compound ID EQbN97nOUMw
InChI InChI=1S/C10H12O2/c1-7-4-5-9(8(2)6-7)10(11)12-3/h4-6H,1-3H3
InChIKey QQCLNRPRQRDMCK-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 6mkzR4YJXPZ
Name Benzoic acid, 2,4-dimethyl-, methyl ester
CAS Registry Number 23617-71-2
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C10H12O2
InChI InChI=1S/C10H12O2/c1-7-4-5-9(8(2)6-7)10(11)12-3/h4-6H,1-3H3
InChIKey QQCLNRPRQRDMCK-UHFFFAOYSA-N
Molecular Weight 164.204 g/mol
SMILES c1(C(=O)OC)c(cc(C)cc1)C
SPLASH splash10-001i-0900000000-803811a402e6f8825fa0
Source of Spectrum JX-2015-6-8631
Synonyms 2,4-(CH3)2-C6H3-COOCH3 Methyl 2,4-dimethylbenzoate 2,4-Dimethylbenzoic acid methyl ester 2,4,-Dimethyl-methylbenzoate
Wiley ID 1730001