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3-(3-aminophenyl)-5-methyl-4-isoxazolecarboxylic acid
SpectraBase Compound ID PS3sEpltdA
InChI InChI=1S/C11H10N2O3/c1-6-9(11(14)15)10(13-16-6)7-3-2-4-8(12)5-7/h2-5H,12H2,1H3,(H,14,15)
InChIKey CAVGYUXRBHNQQQ-UHFFFAOYSA-N
Mol Weight 218.21 g/mol
Molecular Formula C11H10N2O3
Exact Mass 218.069142 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 4NDLVMxn0i9
Name 3-(3-aminophenyl)-5-methyl-4-isoxazolecarboxylic acid
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C11H10N2O3
InChI InChI=1S/C11H10N2O3/c1-6-9(11(14)15)10(13-16-6)7-3-2-4-8(12)5-7/h2-5H,12H2,1H3,(H,14,15)
InChIKey CAVGYUXRBHNQQQ-UHFFFAOYSA-N
Molecular Weight 218.212 g/mol
SMILES Nc1cc(-c2c(C(=O)O)c(on2)C)ccc1
SPLASH splash10-014i-9650000000-2b0bbbf95657e9e62fb2
Source of Spectrum HC-8-808-0
Synonyms 3-(3-aminophenyl)-5-methyl-1,2-oxazole-4-carboxylic acid
Wiley ID 1217326