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1,2-BENZISOTHIAZOLIN-3-ONE, 1,1-DIOXIDE, SODIUM SALT
SpectraBase Compound ID 9HnVPbHpGmg
InChI InChI=1S/C7H5NO3S.Na.2H2O/c9-7-5-3-1-2-4-6(5)12(10,11)8-7;;;/h1-4H,(H,8,9);;2*1H2/q;+1;;/p-1
InChIKey AYGJDUHQRFKLBG-UHFFFAOYSA-M
Mol Weight 241.193 g/mol
Molecular Formula C7H8NNaO5S
Exact Mass 241.002088 g/mol

13C Nuclear Magnetic Resonance (NMR) Spectrum

13C Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID DZc3c4JlHLx
Name 1,2-BENZISOTHIAZOLIN-3-ONE, 1,1-DIOXIDE, SODIUM SALT
Source of Sample Eastman Organic Chemicals, Rochester, New York
Copyright Copyright © 1980, 1981-2025 John Wiley & Sons, Inc. All Rights Reserved.
Formula C7H4NNaO3S 2H2O
InChI InChI=1S/C7H5NO3S.Na.2H2O/c9-7-5-3-1-2-4-6(5)12(10,11)8-7;;;/h1-4H,(H,8,9);;2*1H2/q;+1;;/p-1
InChIKey AYGJDUHQRFKLBG-UHFFFAOYSA-M
Molecular Weight 241.20
Solvent Deuterium oxide; Reference=Dioxane Spectrometer= Varian CFT-20
Synonyms SACCHARIN, SODIUM SALT, DIHYDRATE 1,2-BENZISOSULFONAZOLINE, 3-OXO-, SODIUM SALT, DIHYDRATE