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2-[(2-nitro-1-oxoethyl)amino]acetic acid methyl ester
SpectraBase Compound ID 7XTV7MR6rcV
InChI InChI=1S/C5H8N2O5/c1-12-5(9)2-6-4(8)3-7(10)11/h2-3H2,1H3,(H,6,8)
InChIKey BNFHFYSYWOBECE-UHFFFAOYSA-N
Mol Weight 176.13 g/mol
Molecular Formula C5H8N2O5
Exact Mass 176.043321 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID HEFc2t6Q3S7
Name 2-[(2-nitro-1-oxoethyl)amino]acetic acid methyl ester
Alternate Name(s) 2-[(2-nitroacetyl)amino]acetic acid methyl ester methyl 2-(2-nitroethanoylamino)ethanoate methyl 2-[(2-nitroacetyl)amino]acetate
Comments Less than 3 mono-isotopic peaks
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Formula C5H8N2O5
InChI InChI=1S/C5H8N2O5/c1-12-5(9)2-6-4(8)3-7(10)11/h2-3H2,1H3,(H,6,8)
InChIKey BNFHFYSYWOBECE-UHFFFAOYSA-N
Molecular Weight 176.128 g/mol
SMILES N(C(CN(=O)=O)=O)CC(=O)OC
SPLASH splash10-014i-0900000000-6a68b97b72b3f705935b
Source of Spectrum F-49-2108-9
Wiley ID 1171802