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4-CARBMOYL-7-METHYL-2,3,3A,4,5,6-HEXAHYDRO-1-BENZOTHIOPHENE-4-CARBOXYLIC_ACID_1,1-DIOXIDE
SpectraBase Compound ID Cfgeo9BT0qk
InChI InChI=1S/C11H15NO5S/c1-6-2-4-11(9(12)13,10(14)15)7-3-5-18(16,17)8(6)7/h7H,2-5H2,1H3,(H2,12,13)(H,14,15)/t7-,11+/m0/s1
InChIKey QVZDDSBZZQMPDL-WRWORJQWSA-N
Mol Weight 273.3 g/mol
Molecular Formula C11H15NO5S
Exact Mass 273.067094 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 5G8Wtekh4sy
Name 4-CARBMOYL-7-METHYL-2,3,3A,4,5,6-HEXAHYDRO-1-BENZOTHIOPHENE-4-CARBOXYLIC_ACID_1,1-DIOXIDE
Compound Number XXIV
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C11H15NO5S
InChI InChI=1S/C11H15NO5S/c1-6-2-4-11(9(12)13,10(14)15)7-3-5-18(16,17)8(6)7/h7H,2-5H2,1H3,(H2,12,13)(H,14,15)/t7-,11+/m0/s1
InChIKey QVZDDSBZZQMPDL-WRWORJQWSA-N
Literature Reference Author G.N.ANDREEV,E.E.SHULTS,A.A.VOLKOV,M.M.SHAKIROV,I.Y.BAGRYANSK AYA,Y.V.GATILOV,G.A.
Literature Reference Citation RUSS.J.ORG.CHEM.,40,854(2004)
Literature Reference DOI 10.1023/B:RUJO.0000044549.81561.4f
Molecular Weight 273.304 g/mol
Solvent CDCl3
Source File Reference UWMZ16632