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2-(4-Methylbenzoylamino)-4,5-dimethyl-3-hydrxy-2,3-dihydroisothiazolie 1,1-dioxide
SpectraBase Compound ID 7o7kOicH0FK
InChI InChI=1S/C13H16N2O4S/c1-8-4-6-11(7-5-8)12(16)14-15-13(17)9(2)10(3)20(15,18)19/h4-7,13,17H,1-3H3,(H,14,16)
InChIKey IOTMSYYWWXGUQS-UHFFFAOYSA-N
Mol Weight 296.34 g/mol
Molecular Formula C13H16N2O4S
Exact Mass 296.083078 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID CZo2NtjSAdc
Name 2-(4-Methylbenzoylamino)-4,5-dimethyl-3-hydrxy-2,3-dihydroisothiazolie 1,1-dioxide
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C13H16N2O4S
InChI InChI=1S/C13H16N2O4S/c1-8-4-6-11(7-5-8)12(16)14-15-13(17)9(2)10(3)20(15,18)19/h4-7,13,17H,1-3H3,(H,14,16)
InChIKey IOTMSYYWWXGUQS-UHFFFAOYSA-N
Molecular Weight 296.341 g/mol
SMILES OC1C(=C(S(N1NC(c1ccc(cc1)C)=O)(=O)=O)C)C
SPLASH splash10-014i-3930000000-ad5049a62d9a0232e8e7
Source of Spectrum O1-65-2715-8
Wiley ID 1593322