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2-METHYLTHIO-7-PHENYL-1,2,4-TRIAZOLO-[1,5-A]-PYRIMIDIN-5(8H)-ONE
SpectraBase Compound ID JU8cTP5J2nl
InChI InChI=1S/C12H10N4OS/c1-18-12-14-11-13-9(7-10(17)16(11)15-12)8-5-3-2-4-6-8/h2-7H,1H3,(H,13,14,15)
InChIKey GSHMWZICZVJZCJ-UHFFFAOYSA-N
Mol Weight 258.3 g/mol
Molecular Formula C12H10N4OS
Exact Mass 258.057532 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID K9n0hToe7tJ
Name 2-METHYLTHIO-7-PHENYL-1,2,4-TRIAZOLO-[1,5-A]-PYRIMIDIN-5(8H)-ONE
Compound Number 3/18
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C12H10N4OS
InChI InChI=1S/C12H10N4OS/c1-18-12-14-11-13-9(7-10(17)16(11)15-12)8-5-3-2-4-6-8/h2-7H,1H3,(H,13,14,15)
InChIKey GSHMWZICZVJZCJ-UHFFFAOYSA-N
Literature Reference Author J.REITER,L.PONGO,T.SOMORAI,I.PALLAGI
Literature Reference Citation MH.CHEM.,121,173(1990)
Literature Reference DOI 10.1007/BF00809530
Molecular Weight 258.298 g/mol
Solvent DMSO-D6
Source File Reference UWCS12834