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3-CARBOXYMETHYLSULFONYL-1-ETHYL-2-METHYLPYRROLE-5-CARBOXYLIC_ACID
SpectraBase Compound ID 6pjMc1fXduw
InChI InChI=1S/C10H13NO6S/c1-3-11-6(2)8(4-7(11)10(14)15)18(16,17)5-9(12)13/h4H,3,5H2,1-2H3,(H,12,13)(H,14,15)
InChIKey WDUODWIEBLZCGC-UHFFFAOYSA-N
Mol Weight 275.27 g/mol
Molecular Formula C10H13NO6S
Exact Mass 275.046358 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID A86rUOhNHHd
Name 3-CARBOXYMETHYLSULFONYL-1-ETHYL-2-METHYLPYRROLE-5-CARBOXYLIC_ACID
Compound Number 4C
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Formula C10H13NO6S
InChI InChI=1S/C10H13NO6S/c1-3-11-6(2)8(4-7(11)10(14)15)18(16,17)5-9(12)13/h4H,3,5H2,1-2H3,(H,12,13)(H,14,15)
InChIKey WDUODWIEBLZCGC-UHFFFAOYSA-N
Literature Reference Author C.MORANTA,A.M.MOLINS-PUJOL,M.D.PUJOL,J.BONAL
Literature Reference Citation J.CHEM.SOC.PERKIN-1,3285(1998)
Literature Reference DOI 10.1039/a803239d
Molecular Weight 275.276 g/mol
Solvent DMSO-D6
Source File Reference UWMZ3439