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2,5-Dimethylbenzoic acid
SpectraBase Compound ID 7AA0kKZqTyI
InChI InChI=1S/C9H10O2/c1-6-3-4-7(2)8(5-6)9(10)11/h3-5H,1-2H3,(H,10,11)
InChIKey XZRHNAFEYMSXRG-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 4XPppCckr2
Name Benzoic acid, 2,5-dimethyl-
CAS Registry Number 610-72-0
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C9H10O2
InChI InChI=1S/C9H10O2/c1-6-3-4-7(2)8(5-6)9(10)11/h3-5H,1-2H3,(H,10,11)
InChIKey XZRHNAFEYMSXRG-UHFFFAOYSA-N
Molecular Weight 150.177 g/mol
SMILES OC(c1c(ccc(c1)C)C)=O
SPLASH splash10-0zgi-1900000000-fcefd2a7d23aeb861cae
Source of Spectrum JX-2015-6-7178
Synonyms 2,5-Dimethylbenzoic acid 2,5-Xylic acid 2-Carboxy-1,4-dimethylbenzene Isoxylic acid EINECS 210-235-2
Wiley ID 1729562