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Butanoic acid, 2-(2,1,3-benzothiadiazol-4-ylsulfonylamino)-3-methyl-
SpectraBase Compound ID HxWiuRm940g
InChI InChI=1S/C11H13N3O4S2/c1-6(2)9(11(15)16)14-20(17,18)8-5-3-4-7-10(8)13-19-12-7/h3-6,9,14H,1-2H3,(H,15,16)
InChIKey GGXQUHCKQXDDGR-UHFFFAOYSA-N
Mol Weight 315.36 g/mol
Molecular Formula C11H13N3O4S2
Exact Mass 315.034748 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 4xFMIEdQwa
Name Butanoic acid, 2-(2,1,3-benzothiadiazol-4-ylsulfonylamino)-3-methyl-
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C11H13N3O4S2
InChI InChI=1S/C11H13N3O4S2/c1-6(2)9(11(15)16)14-20(17,18)8-5-3-4-7-10(8)13-19-12-7/h3-6,9,14H,1-2H3,(H,15,16)
InChIKey GGXQUHCKQXDDGR-UHFFFAOYSA-N
Molecular Weight 315.362 g/mol
SMILES N(S(c1c2nsnc2ccc1)(=O)=O)C(C(=O)O)C(C)C
SPLASH splash10-000l-9500000000-7d8a689d9293cee4b10c
Synonyms 2-(2,1,3-benzothiadiazol-4-ylsulfonylamino)-3-methyl-butanoic acid 3-Methyl-2-(piazthiol-4-ylsulfonylamino)butyric acid N-(2,1,3-Benzothiadiazol-4-ylsulfonyl)valine
Wiley ID 1457515