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6,7,8,9,10,11,12,13,14,15-DECAHYDRO-2-METHYLTHIO-CYClODODECA-[D]-[1,2,4]-TRIAZOLO-[1,5-A]-PYRIMIDIN-5(16H)-ONE
SpectraBase Compound ID 4oARSXD04Mi
InChI InChI=1S/C16H24N4OS/c1-22-16-18-15-17-13-11-9-7-5-3-2-4-6-8-10-12(13)14(21)20(15)19-16/h2-11H2,1H3,(H,17,18,19)
InChIKey WIXNKLITIGGSQC-UHFFFAOYSA-N
Mol Weight 320.46 g/mol
Molecular Formula C16H24N4OS
Exact Mass 320.167083 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID ZwD2kqJSLG
Name 6,7,8,9,10,11,12,13,14,15-DECAHYDRO-2-METHYLTHIO-CYClODODECA-[D]-[1,2,4]-TRIAZOLO-[1,5-A]-PYRIMIDIN-5(16H)-ONE
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C16H24N4OS
InChI InChI=1S/C16H24N4OS/c1-22-16-18-15-17-13-11-9-7-5-3-2-4-6-8-10-12(13)14(21)20(15)19-16/h2-11H2,1H3,(H,17,18,19)
InChIKey WIXNKLITIGGSQC-UHFFFAOYSA-N
Literature Reference Author J.REITER,G.BERECZ,I.PALLAGI
Literature Reference Citation J.HETCYCL.CHEM.,28,721(1991)
Literature Reference DOI 10.1002/jhet.5570280329
Molecular Weight 320.453 g/mol
Solvent DMSO-D6:CDCl3=1:3
Source File Reference UWCS19302