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2-hydroxy-3-(6-nitro-3,4-methylenedioxophenyl)propionic acid
SpectraBase Compound ID ExpauILYERu
InChI InChI=1S/C10H9NO7/c12-7(10(13)14)1-5-2-8-9(18-4-17-8)3-6(5)11(15)16/h2-3,7,12H,1,4H2,(H,13,14)
InChIKey NBIYUKDOCYVGLU-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 K3B9XoBjAfv
Name 2-hydroxy-3-(6-nitro-3,4-methylenedioxophenyl)propionic acid
Appearance solid
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Formula C10H9NO7
InChI InChI=1S/C10H9NO7/c12-7(10(13)14)1-5-2-8-9(18-4-17-8)3-6(5)11(15)16/h2-3,7,12H,1,4H2,(H,13,14)
InChIKey NBIYUKDOCYVGLU-UHFFFAOYSA-N
Ionization Type EI
Molecular Weight 255.182 g/mol
Reported Formula C10H9NO7
SMILES OC(C(Cc1cc2c(cc1[N+]([O-])=O)OCO2)O)=O
SPLASH splash10-01x1-0910000000-c85653378bda94300188
Source of Spectrum CN101607954B
Wiley ID 1876978