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(2S)-2-(2,4-dinitroanilino)propanoic acid
SpectraBase Compound ID 6NkyYQHi1Vt
InChI InChI=1S/C9H9N3O6/c1-5(9(13)14)10-7-3-2-6(11(15)16)4-8(7)12(17)18/h2-5,10H,1H3,(H,13,14)/t5-/m0/s1
InChIKey KKHLKORVTUUSBC-YFKPBYRVSA-N
Mol Weight 255.19 g/mol
Molecular Formula C9H9N3O6
Exact Mass 255.049135 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID LOU8ALz792q
Name (2S)-2-(2,4-dinitroanilino)propanoic acid
CAS Registry Number 1655-52-3
Comments Less than 3 mono-isotopic peaks
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Formula C9H9N3O6
InChI InChI=1S/C9H9N3O6/c1-5(9(13)14)10-7-3-2-6(11(15)16)4-8(7)12(17)18/h2-5,10H,1H3,(H,13,14)/t5-/m0/s1
InChIKey KKHLKORVTUUSBC-YFKPBYRVSA-N
Molecular Weight 255.186 g/mol
SMILES N(c1c(N(=O)=O)cc(N(=O)=O)cc1)[C@](C(=O)O)(C)[H]
SPLASH splash10-03di-0090000000-fd45f38b6bd35b206009
Source of Spectrum F-56-8288-0
Wiley ID 859059