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3-[[(E)-4-hydroxy-4-keto-but-2-enoyl]amino]benzoic acid
SpectraBase Compound ID 1aozeDo5f9I
InChI InChI=1S/C11H9NO5/c13-9(4-5-10(14)15)12-8-3-1-2-7(6-8)11(16)17/h1-6H,(H,12,13)(H,14,15)(H,16,17)/b5-4+
InChIKey UXIAYWKXDXAWJB-SNAWJCMRSA-N
Mol Weight 235.19 g/mol
Molecular Formula C11H9NO5
Exact Mass 235.048072 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 83sQjHpjSzD
Name 3-[[(E)-4-oxidanyl-4-oxidanylidene-but-2-enoyl]amino]benzoic acid
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C11H9NO5
InChI InChI=1S/C11H9NO5/c13-9(4-5-10(14)15)12-8-3-1-2-7(6-8)11(16)17/h1-6H,(H,12,13)(H,14,15)(H,16,17)/b5-4+
InChIKey UXIAYWKXDXAWJB-SNAWJCMRSA-N
Molecular Weight 235.195 g/mol
SMILES OC(c1cc(ccc1)NC(\C=C\C(=O)O)=O)=O
SPLASH splash10-000i-9700000000-9c8172fa404c7789ddd7
Synonyms 3-[[(E)-3-carboxy-1-oxoprop-2-enyl]amino]benzoic acid 3-[[(E)-3-carboxyprop-2-enoyl]amino]benzoic acid
Wiley ID 1473607