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2-(3-NITROBENZENESULFONYL)-5,6,7,8-TETRAHYDRO-2H-1,2,3-BENZOTHIADIAZINE-1,1-DIOXIDE
SpectraBase Compound ID LkjSaL0qmz9
InChI InChI=1S/C13H13N3O6S2/c17-15(18)11-5-3-6-12(8-11)23(19,20)16-14-9-10-4-1-2-7-13(10)24(16,21)22/h3,5-6,8-9H,1-2,4,7H2
InChIKey KMTJKIOGBIYQDS-UHFFFAOYSA-N
Mol Weight 371.38 g/mol
Molecular Formula C13H13N3O6S2
Exact Mass 371.024577 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID CmT2lIcA8fs
Name 2-(3-NITROBENZENESULFONYL)-5,6,7,8-TETRAHYDRO-2H-1,2,3-BENZOTHIADIAZINE-1,1-DIOXIDE
Compound Number 8C
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C13H13N3O6S2
InChI InChI=1S/C13H13N3O6S2/c17-15(18)11-5-3-6-12(8-11)23(19,20)16-14-9-10-4-1-2-7-13(10)24(16,21)22/h3,5-6,8-9H,1-2,4,7H2
InChIKey KMTJKIOGBIYQDS-UHFFFAOYSA-N
Literature Reference Author A.KOLBERG,J.SIELER,B.SCHULZE
Literature Reference Citation J.HETCYCL.CHEM.,36,1081(1999)
Literature Reference DOI 10.1002/jhet.5570360441
Molecular Weight 371.383 g/mol
Solvent ACETONE-D6
Source File Reference UWSI24581