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1,2,3-Oxathiazin-4(3H)-one, 5-methyl-6-(4-methylphenyl)-, 2,2-dioxide
SpectraBase Compound ID BZ2ezE8FEiV
InChI InChI=1S/C11H11NO4S/c1-7-3-5-9(6-4-7)10-8(2)11(13)12-17(14,15)16-10/h3-6H,1-2H3,(H,12,13)
InChIKey AUVCWYBOFFMVJG-UHFFFAOYSA-N
Mol Weight 253.27 g/mol
Molecular Formula C11H11NO4S
Exact Mass 253.040879 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID Lv5jJmuonIA
Name 1,2,3-Oxathiazin-4(3H)-one, 5-methyl-6-(4-methylphenyl)-, 2,2-dioxide
CAS Registry Number 55407-96-0
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C11H11NO4S
InChI InChI=1S/C11H11NO4S/c1-7-3-5-9(6-4-7)10-8(2)11(13)12-17(14,15)16-10/h3-6H,1-2H3,(H,12,13)
InChIKey AUVCWYBOFFMVJG-UHFFFAOYSA-N
Molecular Weight 253.272 g/mol
SMILES N1C(C(=C(OS1(=O)=O)c1ccc(cc1)C)C)=O
SPLASH splash10-014i-2920000000-48005e13f06a00eb6c17
Source of Spectrum C-97-1457-0
Synonyms 5-Methyl-6-(4-methylphenyl)-1,2,3-oxathiazin-4(3H)-one 2,2-dioxide 5-Methyl-6-p-tolyl-1,2,3-oxathiazin-4(3H)-one 2,2-dioxide
Wiley ID 1256572