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LMBAQBMNOQODDY-UHFFFAOYSA-N
SpectraBase Compound ID DG6KkQKAXlu
InChI InChI=1S/C9H10N4OS/c1-15-9-11-8-10-6-4-2-3-5(6)7(14)13(8)12-9/h2-4H2,1H3,(H,10,11,12)
InChIKey LMBAQBMNOQODDY-UHFFFAOYSA-N
Mol Weight 222.27 g/mol
Molecular Formula C9H10N4OS
Exact Mass 222.057532 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 8tbJieUFPSN
Name 2-METHYLTHIO-6,7,8,9-TETRAHYDRO-CYCLOPENTA-[1.2-D]-1,2,4-TRIAZOLO-[1.5-A]-PYRIMIDIN-5-ONE
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C9H10N4OS
InChI InChI=1S/C9H10N4OS/c1-15-9-11-8-10-6-4-2-3-5(6)7(14)13(8)12-9/h2-4H2,1H3,(H,10,11,12)
InChIKey LMBAQBMNOQODDY-UHFFFAOYSA-N
Literature Reference Author K.ESSES-REITER,J.REITER
Literature Reference Citation J.HETCYCL.CHEM.,24,1503(1987)
Literature Reference DOI 10.1002/jhet.5570240603
Molecular Weight 222.265 g/mol
Solvent DMSO-D6
Source File Reference UWED7938