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2-(4-hydroxy-3-methoxy-5-nitro-phenyl)-2-keto-acetic acid ethyl ester
SpectraBase Compound ID 5GCTTw2aK1F
InChI InChI=1S/C11H11NO7/c1-3-19-11(15)9(13)6-4-7(12(16)17)10(14)8(5-6)18-2/h4-5,14H,3H2,1-2H3
InChIKey SCIHGMXLYVKLOT-UHFFFAOYSA-N
Mol Weight 269.21 g/mol
Molecular Formula C11H11NO7
Exact Mass 269.053552 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID BIBjAzBtwls
Name 2-(4-hydroxy-3-methoxy-5-nitro-phenyl)-2-keto-acetic acid ethyl ester
CAS Registry Number 125629-37-0
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C11H11NO7
InChI InChI=1S/C11H11NO7/c1-3-19-11(15)9(13)6-4-7(12(16)17)10(14)8(5-6)18-2/h4-5,14H,3H2,1-2H3
InChIKey SCIHGMXLYVKLOT-UHFFFAOYSA-N
Molecular Weight 269.209 g/mol
SMILES Oc1c(N(=O)=O)cc(C(C(=O)OCC)=O)cc1OC
SPLASH splash10-0002-0900000000-00c60dd99fcb8b670fdd
Source of Spectrum H-72-966-0
Synonyms 2-(4-hydroxy-3-methoxy-5-nitrophenyl)-2-oxoacetic acid ethyl ester Ethyl 2-(3-methoxy-5-nitro-4-oxidanyl-phenyl)-2-oxidanylidene-ethanoate Ethyl 2-(4-hydroxy-3-methoxy-5-nitro-phenyl)-2-oxo-acetate
Wiley ID 1272983