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2-(3,4-dihydroxy-5-nitro-phenyl)-2-keto-acetic acid ethyl ester
SpectraBase Compound ID 1amU9cXEKeu
InChI InChI=1S/C10H9NO7/c1-2-18-10(15)8(13)5-3-6(11(16)17)9(14)7(12)4-5/h3-4,12,14H,2H2,1H3
InChIKey ACPFYBYFZMSBCK-UHFFFAOYSA-N
Mol Weight 255.18 g/mol
Molecular Formula C10H9NO7
Exact Mass 255.037902 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 5BqH8Idwenn
Name 2-(3,4-dihydroxy-5-nitro-phenyl)-2-keto-acetic acid ethyl ester
CAS Registry Number 125629-04-1
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C10H9NO7
InChI InChI=1S/C10H9NO7/c1-2-18-10(15)8(13)5-3-6(11(16)17)9(14)7(12)4-5/h3-4,12,14H,2H2,1H3
InChIKey ACPFYBYFZMSBCK-UHFFFAOYSA-N
Molecular Weight 255.182 g/mol
SMILES Oc1cc(cc(c1O)N(=O)=O)C(C(=O)OCC)=O
SPLASH splash10-001i-0900000000-b1415fe8b426c6c26404
Source of Spectrum H-72-966-18
Synonyms 2-(3,4-dihydroxy-5-nitrophenyl)-2-oxoacetic acid ethyl ester Ethyl 2-(3,4-dihydroxy-5-nitro-phenyl)-2-oxo-acetate Ethyl 2-[3-nitro-4,5-bis(oxidanyl)phenyl]-2-oxidanylidene-ethanoate
Wiley ID 1258556