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2,4-Dimethoxy-3-methyl-6-(2-oxopropyl)benzoic acid
SpectraBase Compound ID K1iT79gxmkO
InChI InChI=1S/C13H16O5/c1-7(14)5-9-6-10(17-3)8(2)12(18-4)11(9)13(15)16/h6H,5H2,1-4H3,(H,15,16)
InChIKey LKHUJJYNYLNIKR-UHFFFAOYSA-N
Mol Weight 252.27 g/mol
Molecular Formula C13H16O5
Exact Mass 252.099774 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 6CxxTwzN8Fm
Name 2,4-Dimethoxy-3-methyl-6-(2-oxopropyl)benzoic acid
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C13H16O5
InChI InChI=1S/C13H16O5/c1-7(14)5-9-6-10(17-3)8(2)12(18-4)11(9)13(15)16/h6H,5H2,1-4H3,(H,15,16)
InChIKey LKHUJJYNYLNIKR-UHFFFAOYSA-N
Molecular Weight 252.266 g/mol
SMILES OC(c1c(c(C)c(cc1CC(=O)C)OC)OC)=O
SPLASH splash10-0006-0900000000-52650034bbdc00262a61
Source of Spectrum KC-1988-752-9
Synonyms 2,4-Dimethoxy-3-methyl-6-(2-oxidanylidenepropyl)benzoic acid
Wiley ID 1255362