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DIMETHYL-(2-BENZYL-3-MORPHOLINO-2H-1,2,4-TRIAZOL-5-YL)-IMINODITHIOCARBONATE

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DIMETHYL-(2-BENZYL-3-MORPHOLINO-2H-1,2,4-TRIAZOL-5-YL)-IMINODITHIOCARBONATE
SpectraBase Compound ID 3KgxqRKQn1N
InChI InChI=1S/C16H21N5OS2/c1-23-16(24-2)19-14-18-15(17-13-8-9-22-11-13)21(20-14)10-12-6-4-3-5-7-12/h3-7,13H,8-11H2,1-2H3,(H,17,18,20)
InChIKey MOKMEZJCVNAABM-UHFFFAOYSA-N
Mol Weight 363.5 g/mol
Molecular Formula C16H21N5OS2
Exact Mass 363.118753 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID Cs4rLkfs4HT
Name DIMETHYL-(2-BENZYL-3-MORPHOLINO-2H-1,2,4-TRIAZOL-5-YL)-IMINODITHIOCARBONATE
Compound Number 4B/12
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C16H21N5OS2
InChI InChI=1S/C16H21N5OS2/c1-23-16(24-2)19-14-18-15(17-13-8-9-22-11-13)21(20-14)10-12-6-4-3-5-7-12/h3-7,13H,8-11H2,1-2H3,(H,17,18,20)
InChIKey MOKMEZJCVNAABM-UHFFFAOYSA-N
Literature Reference Author J.REITER,L.PONGO,I.PALLAGI
Literature Reference Citation J.HETCYCL.CHEM.,27,1689(1990)
Literature Reference DOI 10.1002/jhet.5570270633
Molecular Weight 363.496 g/mol
Solvent DMSO-D6
Source File Reference UWCP3287