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2-(4-hydroxy-3,5-dimethyl-benzoyl)benzoic acid methyl ester
SpectraBase Compound ID KM2LioAuprL
InChI InChI=1S/C17H16O4/c1-10-8-12(9-11(2)15(10)18)16(19)13-6-4-5-7-14(13)17(20)21-3/h4-9,18H,1-3H3
InChIKey AEIZQJLRPXGVBX-UHFFFAOYSA-N
Mol Weight 284.31 g/mol
Molecular Formula C17H16O4
Exact Mass 284.104859 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID HQRD8pX5IvQ
Name 2-(4-hydroxy-3,5-dimethyl-benzoyl)benzoic acid methyl ester
Alternate Name(s) 2-[(4-hydroxy-3,5-dimethylphenyl)-oxomethyl]benzoic acid methyl ester Methyl 2-(3,5-dimethyl-4-oxidanyl-phenyl)carbonylbenzoate Methyl 2-(4-hydroxy-3,5-dimethyl-benzoyl)benzoate
CAS Registry Number 85604-75-7
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C17H16O4
InChI InChI=1S/C17H16O4/c1-10-8-12(9-11(2)15(10)18)16(19)13-6-4-5-7-14(13)17(20)21-3/h4-9,18H,1-3H3
InChIKey AEIZQJLRPXGVBX-UHFFFAOYSA-N
Molecular Weight 284.311 g/mol
SMILES Oc1c(cc(C(c2c(C(=O)OC)cccc2)=O)cc1C)C
SPLASH splash10-0002-0920000000-0c231fd3dd0653e01f21
Source of Spectrum K-116-975-0
Wiley ID 1288051