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5-[(2,4,6(1H,3H,5H)-trioxopyrimidin-5-ylidenemethyl)amino]salicylic
SpectraBase Compound ID 1fV3jgWOmhu
InChI InChI=1S/C12H9N3O6/c16-8-2-1-5(3-6(8)11(19)20)13-4-7-9(17)14-12(21)15-10(7)18/h1-4,7,16H,(H,19,20)(H2,14,15,17,18,21)/b13-4+
InChIKey YFPUQXAJLRSHHR-YIXHJXPBSA-N
Mol Weight 291.22 g/mol
Molecular Formula C12H9N3O6
Exact Mass 291.049135 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID I91AUiG14Mh
Name 5-[(2,4,6(1H,3H,5H)-trioxopyrimidin-5-ylidenemethyl)amino]salicylic
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C12H9N3O6
InChI InChI=1S/C12H9N3O6/c16-8-2-1-5(3-6(8)11(19)20)13-4-7-9(17)14-12(21)15-10(7)18/h1-4,7,16H,(H,19,20)(H2,14,15,17,18,21)/b13-4+
InChIKey YFPUQXAJLRSHHR-YIXHJXPBSA-N
Molecular Weight 291.219 g/mol
SMILES N1C(NC(C(\C=N\c2cc(C(=O)O)c(cc2)O)C1=O)=O)=O
SPLASH splash10-052o-9200000000-6e0d0d82671584a45d45
Synonyms 2-Hydroxy-5-{[(2,4,6-trioxohexahydro-5-pyrimidinyl)methylidene]amino}benzoic acid 2-Hydroxy-5-{[(E)-(2,4,6-trioxohexahydro-5-pyrimidinyl)methylidene]amino}benzoic acid
Wiley ID 1466959