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3-(2,4-Dinitroanilino)propanoic acid
SpectraBase Compound ID 3tqnTGXMPdt
InChI InChI=1S/C9H9N3O6/c13-9(14)3-4-10-7-2-1-6(11(15)16)5-8(7)12(17)18/h1-2,5,10H,3-4H2,(H,13,14)
InChIKey XSSZEVXYIHNWQO-UHFFFAOYSA-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 4NzMqCbJl0O
Name 3-(2,4-Dinitroanilino)propanoic acid
Alternate Name(s) 3-(2,4-dinitroanilino)propionic acid 3-[(2,4-dinitrophenyl)amino]propanoic acid
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C9H9N3O6
InChI InChI=1S/C9H9N3O6/c13-9(14)3-4-10-7-2-1-6(11(15)16)5-8(7)12(17)18/h1-2,5,10H,3-4H2,(H,13,14)
InChIKey XSSZEVXYIHNWQO-UHFFFAOYSA-N
Molecular Weight 255.186 g/mol
SMILES N(c1ccc(cc1N(=O)=O)N(=O)=O)CCC(=O)O
SPLASH splash10-002b-7910000000-bbebe34f196bf3b270d4
Wiley ID 1480787