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Benzoic acid, o-(o-toluoyl)-, methyl ester
SpectraBase Compound ID CZrKU5jaQvx
InChI InChI=1S/C16H14O3/c1-11-7-3-4-8-12(11)15(17)13-9-5-6-10-14(13)16(18)19-2/h3-10H,1-2H3
InChIKey HFCIXDZCBXKGQQ-UHFFFAOYSA-N
Mol Weight 254.28 g/mol
Molecular Formula C16H14O3
Exact Mass 254.094294 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 8smIzQERpKo
Name Benzoic acid, o-(o-toluoyl)-, methyl ester
Alternate Name(s) Methyl 2-(2-methylbenzoyl)benzoate 2-o-toluoylbenzoic acid methyl ester 2-[(2-methylphenyl)-oxomethyl]benzoic acid methyl ester Methyl 2-(2-methylphenyl)carbonylbenzoate
CAS Registry Number 21147-26-2
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C16H14O3
InChI InChI=1S/C16H14O3/c1-11-7-3-4-8-12(11)15(17)13-9-5-6-10-14(13)16(18)19-2/h3-10H,1-2H3
InChIKey HFCIXDZCBXKGQQ-UHFFFAOYSA-N
Molecular Weight 254.285 g/mol
SMILES Cc1ccccc1C(c1ccccc1C(=O)OC)=O
SPLASH splash10-022c-4940000000-dbceb9b067b7cf8b3710
Source of Spectrum T-68-3573-0
Wiley ID 1258035