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1-[4-(THIOMORPHOLINO-SULFONYL)-PHENYL]-1H-PYRROLE-2,5-DIONE;LASSBIO-1447
SpectraBase Compound ID BMzPN2SRUvi
InChI InChI=1S/C14H14N2O4S2/c17-13-5-6-14(18)16(13)11-1-3-12(4-2-11)22(19,20)15-7-9-21-10-8-15/h1-6H,7-10H2
InChIKey AHQUNBHOQXLBMF-UHFFFAOYSA-N
Mol Weight 338.4 g/mol
Molecular Formula C14H14N2O4S2
Exact Mass 338.039499 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID HlUf7Vt8yl5
Name 1-[4-(THIOMORPHOLINO-SULFONYL)-PHENYL]-1H-PYRROLE-2,5-DIONE;LASSBIO-1447
Compound Number 3
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C14H14N2O4S2
InChI InChI=1S/C14H14N2O4S2/c17-13-5-6-14(18)16(13)11-1-3-12(4-2-11)22(19,20)15-7-9-21-10-8-15/h1-6H,7-10H2
InChIKey AHQUNBHOQXLBMF-UHFFFAOYSA-N
Literature Reference Author M.L.D.C.BARBOSA,T.J.F.RAMOS,A.C.S.D.ARANTES,M.A.MARTINS,P.M. R.E.SILVA
Literature Reference Citation MOLECULES,17,14651(2012)
Literature Reference DOI 10.3390/molecules171214651
Molecular Weight 338.396 g/mol
Sample ID 955
Solvent DMSO-D6