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3-(p-Tolylsulfonyl)-5-bromo-1,2,3-benzoxathiazole 2,2-Dioxide
SpectraBase Compound ID 55ZzUNWzfzr
InChI InChI=1S/C13H10BrNO5S2/c1-9-2-5-11(6-3-9)21(16,17)15-12-8-10(14)4-7-13(12)20-22(15,18)19/h2-8H,1H3
InChIKey RRDMBTMDCZTSJF-UHFFFAOYSA-N
Mol Weight 404.25 g/mol
Molecular Formula C13H10BrNO5S2
Exact Mass 402.918378 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID I3KyFsaeVcb
Name 3-(p-Tolylsulfonyl)-5-bromo-1,2,3-benzoxathiazole 2,2-Dioxide
CAS Registry Number 136061-83-1
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C13H10BrNO5S2
InChI InChI=1S/C13H10BrNO5S2/c1-9-2-5-11(6-3-9)21(16,17)15-12-8-10(14)4-7-13(12)20-22(15,18)19/h2-8H,1H3
InChIKey RRDMBTMDCZTSJF-UHFFFAOYSA-N
Molecular Weight 404.249 g/mol
SMILES c12OS(N(c2cc(cc1)Br)S(c1ccc(cc1)C)(=O)=O)(=O)=O
SPLASH splash10-0a4o-9900000000-8d90ef65760980990395
Source of Spectrum J-56-6513-1
Synonyms 5-Bromo-3-[(4-methylphenyl)sulfonyl]-3H-1,2,3-benzoxathiazole 2,2-dioxide
Wiley ID 1370769