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2,4,6-Trimethylbenzoic acid
SpectraBase Compound ID Ancv2EWh2jb
InChI InChI=1S/C10H12O2/c1-6-4-7(2)9(10(11)12)8(3)5-6/h4-5H,1-3H3,(H,11,12)
InChIKey FFFIRKXTFQCCKJ-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 8dbVMtROvQn
Name Benzoic acid, 2,4,6-trimethyl-
Alternate Name(s) 2,4,6-Trimethylbenzoic acid .beta.-Isodurylic acid Mesitoic acid Mesitylenecarboxylic acid BRN 1866187 EINECS 207-553-9 NSC 1119
CAS Registry Number 480-63-7
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C10H12O2
InChI InChI=1S/C10H12O2/c1-6-4-7(2)9(10(11)12)8(3)5-6/h4-5H,1-3H3,(H,11,12)
InChIKey FFFIRKXTFQCCKJ-UHFFFAOYSA-N
Molecular Weight 164.204 g/mol
SMILES OC(=O)c1c(C)cc(C)cc1C
SPLASH splash10-00kb-0900000000-cf368ebf89abb4d3503d
Source of Spectrum AD-0-4320-0
Wiley ID 1160197