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3,4-Dimethylbenzoic acid
SpectraBase Compound ID LcsUhZv485j
InChI InChI=1S/C9H10O2/c1-6-3-4-8(9(10)11)5-7(6)2/h3-5H,1-2H3,(H,10,11)
InChIKey OPVAJFQBSDUNQA-UHFFFAOYSA-N
Mol Weight 150.18 g/mol
Molecular Formula C9H10O2
Exact Mass 150.06808 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 93VaCa013Zm
Name Benzoic acid, 3,4-dimethyl-
Alternate Name(s) 3,4-Dimethylbenzoic acid 1-Carboxy-3,4-dimethylbenzene 3,4-Xylic acid BRN 0907267 EINECS 210-576-7
CAS Registry Number 619-04-5
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C9H10O2
InChI InChI=1S/C9H10O2/c1-6-3-4-8(9(10)11)5-7(6)2/h3-5H,1-2H3,(H,10,11)
InChIKey OPVAJFQBSDUNQA-UHFFFAOYSA-N
Molecular Weight 150.177 g/mol
SMILES OC(c1ccc(C)c(C)c1)=O
SPLASH splash10-0pb9-7900000000-823477106c1c72ea0655
Source of Spectrum WS-1986-485-0
Wiley ID 1146913