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2-[Methyl(2-oxobutanoyl)amino]benzoic acid
SpectraBase Compound ID LuoCef2HgIi
InChI InChI=1S/C12H13NO4/c1-3-10(14)11(15)13(2)9-7-5-4-6-8(9)12(16)17/h4-7H,3H2,1-2H3,(H,16,17)
InChIKey QGVZVZUSSVMQCM-UHFFFAOYSA-N
Mol Weight 235.24 g/mol
Molecular Formula C12H13NO4
Exact Mass 235.084458 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 3PqPT06BnQW
Name 2-[Methyl(2-oxobutanoyl)amino]benzoic acid
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C12H13NO4
InChI InChI=1S/C12H13NO4/c1-3-10(14)11(15)13(2)9-7-5-4-6-8(9)12(16)17/h4-7H,3H2,1-2H3,(H,16,17)
InChIKey QGVZVZUSSVMQCM-UHFFFAOYSA-N
Molecular Weight 235.239 g/mol
SMILES OC(c1c(N(C(C(=O)CC)=O)C)cccc1)=O
SPLASH splash10-056r-2900000000-da6784960da2cc951ff5
Source of Spectrum F-69-10834-3n
Synonyms 2-(N-methyl-2-oxobutanamido)benzoic acid
Wiley ID 1738697