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3-(p-Tolylsulfonyl)-5-tert-butyl-1,2,3-benzoxathiazole 2,2-Dioxide
SpectraBase Compound ID 4lGJxpK4qq8
InChI InChI=1S/C17H19NO5S2/c1-12-5-8-14(9-6-12)24(19,20)18-15-11-13(17(2,3)4)7-10-16(15)23-25(18,21)22/h5-11H,1-4H3
InChIKey BZUWKOUEEJHMGJ-UHFFFAOYSA-N
Mol Weight 381.46 g/mol
Molecular Formula C17H19NO5S2
Exact Mass 381.070465 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 7jQjii67FoB
Name 3-(p-Tolylsulfonyl)-5-tert-butyl-1,2,3-benzoxathiazole 2,2-Dioxide
CAS Registry Number 136061-82-0
Comments Less than 3 mono-isotopic peaks
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Formula C17H19NO5S2
InChI InChI=1S/C17H19NO5S2/c1-12-5-8-14(9-6-12)24(19,20)18-15-11-13(17(2,3)4)7-10-16(15)23-25(18,21)22/h5-11H,1-4H3
InChIKey BZUWKOUEEJHMGJ-UHFFFAOYSA-N
Molecular Weight 381.461 g/mol
SMILES c12OS(N(c2cc(C(C)(C)C)cc1)S(c1ccc(cc1)C)(=O)=O)(=O)=O
SPLASH splash10-0a4i-0901000000-d8f4effb6a06454f2e4e
Source of Spectrum J-56-6513-1
Synonyms 5-tert-butyl-3-[(4-methylphenyl)sulfonyl]-3H-1,2,3-benzoxathiazole 2,2-dioxide
Wiley ID 1360097