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2-((ETHOXYCARBONYLAMINOTHIOXOMETHYL)-AMINO)-4,7-DIHYDRO-5H-THIENO-[2,3-C]-THIOPYRAN-3-CARBOXYLIC-ACID-ETHYLESTER
SpectraBase Compound ID APjST1Yqq0e
InChI InChI=1S/C14H18N2O4S3/c1-3-19-12(17)10-8-5-6-22-7-9(8)23-11(10)15-13(21)16-14(18)20-4-2/h3-7H2,1-2H3,(H2,15,16,18,21)
InChIKey KKDDFFBXMZIEIV-UHFFFAOYSA-N
Mol Weight 374.49 g/mol
Molecular Formula C14H18N2O4S3
Exact Mass 374.042871 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID JW5owOPVMR6
Name 2-((ETHOXYCARBONYLAMINOTHIOXOMETHYL)-AMINO)-4,7-DIHYDRO-5H-THIENO-[2,3-C]-THIOPYRAN-3-CARBOXYLIC-ACID-ETHYLESTER
Compound Number 3
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C14H18N2O4S3
InChI InChI=1S/C14H18N2O4S3/c1-3-19-12(17)10-8-5-6-22-7-9(8)23-11(10)15-13(21)16-14(18)20-4-2/h3-7H2,1-2H3,(H2,15,16,18,21)
InChIKey KKDDFFBXMZIEIV-UHFFFAOYSA-N
Literature Reference Author E.K.AHMED
Literature Reference Citation MH.CHEM.,126,953(1995)
Literature Reference DOI 10.1007/BF00811015
Molecular Weight 374.488 g/mol
Solvent CDCl3
Source File Reference UWKA2