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6-CHLORO-7-METHYL-2-METHYLTHIO-1,2,4-TRIAZOLO-[1,5-A]-PYRIMIDIN-5(8H)-ONE
SpectraBase Compound ID Ev3Fe3tjzVg
InChI InChI=1S/C7H7ClN4OS/c1-3-4(8)5(13)12-6(9-3)10-7(11-12)14-2/h1-2H3,(H,9,10,11)
InChIKey QAHFEKQJHYQYRA-UHFFFAOYSA-N
Mol Weight 230.67 g/mol
Molecular Formula C7H7ClN4OS
Exact Mass 230.00291 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 86UL95q88Oz
Name 6-CHLORO-7-METHYL-2-METHYLTHIO-1,2,4-TRIAZOLO-[1,5-A]-PYRIMIDIN-5(8H)-ONE
Compound Number 3/26
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C7H7ClN4OS
InChI InChI=1S/C7H7ClN4OS/c1-3-4(8)5(13)12-6(9-3)10-7(11-12)14-2/h1-2H3,(H,9,10,11)
InChIKey QAHFEKQJHYQYRA-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 230.672 g/mol
Solvent DMSO-D6
Source File Reference UWCS12842