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1,2,3-Oxathiazin-4(3H)-one, 6-(4-chlorophenyl)-5-methyl-, 2,2-dioxide
SpectraBase Compound ID 9mWMK47RR7D
InChI InChI=1S/C10H8ClNO4S/c1-6-9(7-2-4-8(11)5-3-7)16-17(14,15)12-10(6)13/h2-5H,1H3,(H,12,13)
InChIKey RDRYZBMLRVPEPO-UHFFFAOYSA-N
Mol Weight 273.69 g/mol
Molecular Formula C10H8ClNO4S
Exact Mass 272.986257 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 1qkc6gCUsWC
Name 1,2,3-Oxathiazin-4(3H)-one, 6-(4-chlorophenyl)-5-methyl-, 2,2-dioxide
CAS Registry Number 55408-00-9
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C10H8ClNO4S
InChI InChI=1S/C10H8ClNO4S/c1-6-9(7-2-4-8(11)5-3-7)16-17(14,15)12-10(6)13/h2-5H,1H3,(H,12,13)
InChIKey RDRYZBMLRVPEPO-UHFFFAOYSA-N
Molecular Weight 273.690 g/mol
SMILES N1C(C(=C(OS1(=O)=O)c1ccc(cc1)Cl)C)=O
SPLASH splash10-000i-0910000000-531aba5065b34015c99c
Source of Spectrum C-97-1457-0
Synonyms 6-(4-Chlorophenyl)-5-methyl-1,2,3-oxathiazin-4(3H)-one 2,2-dioxide 6-(o-chlorophenyl)-5-methyl-1,2,3-oxathiazin-4(3H)-one 2,2-dioxide
Wiley ID 1276955