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2,6-Dimethylbenzoic acid
SpectraBase Compound ID HJbgv66V2dq
InChI InChI=1S/C9H10O2/c1-6-4-3-5-7(2)8(6)9(10)11/h3-5H,1-2H3,(H,10,11)
InChIKey HCBHQDKBSKYGCK-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 HhOByq9UlPw
Name Benzoic acid, 2,6-dimethyl-
CAS Registry Number 632-46-2
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C9H10O2
InChI InChI=1S/C9H10O2/c1-6-4-3-5-7(2)8(6)9(10)11/h3-5H,1-2H3,(H,10,11)
InChIKey HCBHQDKBSKYGCK-UHFFFAOYSA-N
Molecular Weight 150.177 g/mol
SMILES OC(c1c(cccc1C)C)=O
SPLASH splash10-0ue9-2900000000-cb6452fa3cc842d5cea1
Source of Spectrum JX-2015-6-8613
Synonyms 2,6-Dimethylbenzoic acid 2,6-Xylic acid BRN 1863791 EINECS 211-177-0
Wiley ID 1729994