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METHYL-5,9-DIOXO-3,4,5,9-TETRAHYDRO-2H-THIENO-[2',3':4,5]-BENZO-[1,2-B]-[1,4]-THIAZINE-7-CARBOXYLATE-1,1-DIOXIDE
SpectraBase Compound ID 4AIZbElNPZd
InChI InChI=1S/C12H9NO6S2/c1-19-12(16)6-4-5-8(14)11-7(9(15)10(5)20-6)13-2-3-21(11,17)18/h4,13H,2-3H2,1H3
InChIKey RPYKNYUNKWDBCY-UHFFFAOYSA-N
Mol Weight 327.33 g/mol
Molecular Formula C12H9NO6S2
Exact Mass 326.987129 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 3YgoJCMPXmS
Name METHYL-5,9-DIOXO-3,4,5,9-TETRAHYDRO-2H-THIENO-[2',3':4,5]-BENZO-[1,2-B]-[1,4]-THIAZINE-7-CARBOXYLATE-1,1-DIOXIDE
Compound Number 10A
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C12H9NO6S2
InChI InChI=1S/C12H9NO6S2/c1-19-12(16)6-4-5-8(14)11-7(9(15)10(5)20-6)13-2-3-21(11,17)18/h4,13H,2-3H2,1H3
InChIKey RPYKNYUNKWDBCY-UHFFFAOYSA-N
Literature Reference Author C.F.C.LAM,A.N.PEARCE,S.H.TAN,M.KAISER,B.R.COPP
Literature Reference Citation MAR.DRUGS,11,3472(2013)
Literature Reference DOI 10.3390/md11093472
Molecular Weight 327.327 g/mol
Source File Reference UWBT6468