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Methyl 5-Acetyl-2-hydroxy-3,6-dimethylbenzoate

View entire compound with spectra: 1 MS (GC)

Methyl 5-Acetyl-2-hydroxy-3,6-dimethylbenzoate
SpectraBase Compound ID I8ZzaOZVe6
InChI InChI=1S/C12H14O4/c1-6-5-9(8(3)13)7(2)10(11(6)14)12(15)16-4/h5,14H,1-4H3
InChIKey FPFNVNDYHNYJQT-UHFFFAOYSA-N
Mol Weight 222.24 g/mol
Molecular Formula C12H14O4
Exact Mass 222.089209 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 4PdSSTf51c
Name Methyl 5-Acetyl-2-hydroxy-3,6-dimethylbenzoate
Alternate Name(s) 5-Acetyl-2-hydroxy-3,6-dimethyl-benzoic acid methyl ester Methyl 3-acetyl-6-hydroxy-2,5-dimethylbenzoate Methyl 3-ethanoyl-2,5-dimethyl-6-oxidanyl-benzoate 5-Acetyl-2-hydroxy-3,6-dimethylbenzoic acid methyl ester
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C12H14O4
InChI InChI=1S/C12H14O4/c1-6-5-9(8(3)13)7(2)10(11(6)14)12(15)16-4/h5,14H,1-4H3
InChIKey FPFNVNDYHNYJQT-UHFFFAOYSA-N
Molecular Weight 222.240 g/mol
SMILES Oc1c(C(=O)OC)c(c(cc1C)C(=O)C)C
SPLASH splash10-002f-0920000000-469d330120a399126348
Source of Spectrum Y1-45-9179-4
Wiley ID 1622286