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2-ETHOXYCARBONYLETHYL-(5-AMINO-3-MORPHOLINO-1,2,4-TRIAZOL-1-YL)-DITHIOCARBONATE

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2-ETHOXYCARBONYLETHYL-(5-AMINO-3-MORPHOLINO-1,2,4-TRIAZOL-1-YL)-DITHIOCARBONATE
SpectraBase Compound ID C3RFMLTnsKF
InChI InChI=1S/C12H19N5O3S2/c1-2-20-9(18)3-8-22-12(21)17-10(13)14-11(15-17)16-4-6-19-7-5-16/h2-8H2,1H3,(H2,13,14,15)
InChIKey VJXWNAVJIIYCMU-UHFFFAOYSA-N
Mol Weight 345.44 g/mol
Molecular Formula C12H19N5O3S2
Exact Mass 345.092932 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID BjojoT9sMWc
Name 2-ETHOXYCARBONYLETHYL-(5-AMINO-3-MORPHOLINO-1,2,4-TRIAZOL-1-YL)-DITHIOCARBONATE
Compound Number 2A/13
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C12H19N5O3S2
InChI InChI=1S/C12H19N5O3S2/c1-2-20-9(18)3-8-22-12(21)17-10(13)14-11(15-17)16-4-6-19-7-5-16/h2-8H2,1H3,(H2,13,14,15)
InChIKey VJXWNAVJIIYCMU-UHFFFAOYSA-N
Literature Reference Author L.PONGO,J.REITER,J.BARKOCZY,P.SOHAR,I.PALLAGI
Literature Reference Citation J.HETCYCL.CHEM.,27,1249(1990)
Literature Reference DOI 10.1002/jhet.5570270516
Molecular Weight 345.435 g/mol
Solvent DMSO-D6
Source File Reference UWMZ1071