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beta-alanine, N-(2,1,3-benzoxadiazol-4-ylsulfonyl)-
SpectraBase Compound ID 5vDrNbwpwki
InChI InChI=1S/C9H9N3O5S/c13-8(14)4-5-10-18(15,16)7-3-1-2-6-9(7)12-17-11-6/h1-3,10H,4-5H2,(H,13,14)
InChIKey HPTFNLACMVDWRF-UHFFFAOYSA-N
Mol Weight 271.25 g/mol
Molecular Formula C9H9N3O5S
Exact Mass 271.026292 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID GxDXbgSatVG
Name 3-(2,1,3-benzoxadiazol-4-ylsulfonylamino)propanoic acid
Alternate Name(s) 3-(benzofurazan-4-ylsulfonylamino)propionic acid Propionic acid, 3-(benzo[1,2,5]oxadiazole-4-sulfonylamino)-
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Formula C9H9N3O5S
InChI InChI=1S/C9H9N3O5S/c13-8(14)4-5-10-18(15,16)7-3-1-2-6-9(7)12-17-11-6/h1-3,10H,4-5H2,(H,13,14)
InChIKey HPTFNLACMVDWRF-UHFFFAOYSA-N
Molecular Weight 271.247 g/mol
SMILES N(S(c1c2c(non2)ccc1)(=O)=O)CCC(=O)O
SPLASH splash10-03l9-9410000000-01f670f994142dcee4de
Wiley ID 1439192