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1-(2,6-dimethylphenyl)-3-pyrimidin-2-ylthiourea
SpectraBase Compound ID FhsTFtiXbCr
InChI InChI=1S/C13H14N4S/c1-9-5-3-6-10(2)11(9)16-13(18)17-12-14-7-4-8-15-12/h3-8H,1-2H3,(H2,14,15,16,17,18)
InChIKey WBCOQEHDHDBAOH-UHFFFAOYSA-N
Mol Weight 258.34 g/mol
Molecular Formula C13H14N4S
Exact Mass 258.093918 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 4FOvI0Zra0r
Name 1-(2,6-dimethylphenyl)-3-pyrimidin-2-ylthiourea
Compound Number 2C
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C13H14N4S
InChI InChI=1S/C13H14N4S/c1-9-5-3-6-10(2)11(9)16-13(18)17-12-14-7-4-8-15-12/h3-8H,1-2H3,(H2,14,15,16,17,18)
InChIKey WBCOQEHDHDBAOH-UHFFFAOYSA-N
Literature Reference Author G.HEINISCH,P.LUKAVSKY,B.MATUSZCZAK,D.RAKOWITZ
Literature Reference Citation MAGN.RES.CHEM.,35,653(1997)
Literature Reference DOI 10.1002/(sici)1097-458x(199709)35:9<653::aid-omr136>3.0.co;2-x
Molecular Weight 258.341 g/mol
Solvent DMSO-D6
Source File Reference UWCP4153