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4-Methoxy-2-methylbenzoic acid
SpectraBase Compound ID CX0ZXGwJpr0
InChI InChI=1S/C9H10O3/c1-6-5-7(12-2)3-4-8(6)9(10)11/h3-5H,1-2H3,(H,10,11)
InChIKey MSVRGYOYISBGTH-UHFFFAOYSA-N
Mol Weight 166.18 g/mol
Molecular Formula C9H10O3
Exact Mass 166.062994 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 4bGnlycmqoh
Name 4-Methoxy-2-methylbenzoic acid
CAS Registry Number 6245-57-4
Comments Less than 3 mono-isotopic peaks
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C9H10O3
InChI InChI=1S/C9H10O3/c1-6-5-7(12-2)3-4-8(6)9(10)11/h3-5H,1-2H3,(H,10,11)
InChIKey MSVRGYOYISBGTH-UHFFFAOYSA-N
Molecular Weight 166.176 g/mol
SMILES OC(c1c(cc(cc1)OC)C)=O
SPLASH splash10-00kb-0900000000-ea4b37ab5f38938c0d67
Source of Spectrum SO-0-724-3
Synonyms 2-methyl-4-methoxybenzoic acid 4-methoxy-2-methyl-benzoic acid
Wiley ID 1539573