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2-[(CARBOXYMETHYL)-THIO]-7-CYCLOPROPYL-3-NITRO-4-OXO-4,7-DIHYDROTHIENO-[2,3-B]-PYRIDINE-5-CARBOXYLIC-ACID
SpectraBase Compound ID 9mWaGCC0ZQ3
InChI InChI=1S/C13H10N2O7S2/c16-7(17)4-23-13-9(15(21)22)8-10(18)6(12(19)20)3-14(5-1-2-5)11(8)24-13/h3,5H,1-2,4H2,(H,16,17)(H,19,20)
InChIKey DTWYNUCBZCJBRZ-UHFFFAOYSA-N
Mol Weight 370.35 g/mol
Molecular Formula C13H10N2O7S2
Exact Mass 369.992943 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID LTiFoLR44L2
Name 2-[(CARBOXYMETHYL)-THIO]-7-CYCLOPROPYL-3-NITRO-4-OXO-4,7-DIHYDROTHIENO-[2,3-B]-PYRIDINE-5-CARBOXYLIC-ACID
Compound Number 7A
Copyright Copyright © 2016-2025 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C13H10N2O7S2
InChI InChI=1S/C13H10N2O7S2/c16-7(17)4-23-13-9(15(21)22)8-10(18)6(12(19)20)3-14(5-1-2-5)11(8)24-13/h3,5H,1-2,4H2,(H,16,17)(H,19,20)
InChIKey DTWYNUCBZCJBRZ-UHFFFAOYSA-N
Literature Reference Author M.H.AL-HUNITI,M.M.EL-ABADELAH,J.A.ZAHRA,S.S.SABRI,A.INGENDOH
Literature Reference Citation MOLECULES,12,497(2007)
Literature Reference DOI 10.3390/12030497
Molecular Weight 370.352 g/mol
Sample ID 57554
Solvent DMSO-D6