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6,7,8,9,10,11-HEXAHYDRO-2-METHYLTHIO-CYClOOCTA-[D]-[1,2,4]-TRIAZOLO-[1,5-A]-PYRIMIDIN-5(12H)-ONE
SpectraBase Compound ID 7PEpF0K9dTA
InChI InChI=1S/C12H16N4OS/c1-18-12-14-11-13-9-7-5-3-2-4-6-8(9)10(17)16(11)15-12/h2-7H2,1H3,(H,13,14,15)
InChIKey FPTPTDDIHRTSSP-UHFFFAOYSA-N
Mol Weight 264.35 g/mol
Molecular Formula C12H16N4OS
Exact Mass 264.104482 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID KkUKBCByDDN
Name 6,7,8,9,10,11-HEXAHYDRO-2-METHYLTHIO-CYClOOCTA-[D]-[1,2,4]-TRIAZOLO-[1,5-A]-PYRIMIDIN-5(12H)-ONE
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C12H16N4OS
InChI InChI=1S/C12H16N4OS/c1-18-12-14-11-13-9-7-5-3-2-4-6-8(9)10(17)16(11)15-12/h2-7H2,1H3,(H,13,14,15)
InChIKey FPTPTDDIHRTSSP-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 264.345 g/mol
Solvent DMSO-D6:CDCl3=1:3
Source File Reference UWCS19294