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METHYL-3-(2-THIOMETHYL-6-TRICHLOROMETHYL-PYRIMIDIN-4-YL)-PROPANOATE
SpectraBase Compound ID HzFSB0bff5A
InChI InChI=1S/C10H11Cl3N2O2S/c1-17-8(16)4-3-6-5-7(10(11,12)13)15-9(14-6)18-2/h5H,3-4H2,1-2H3
InChIKey SMSQAIVUSTWPIM-UHFFFAOYSA-N
Mol Weight 329.63 g/mol
Molecular Formula C10H11Cl3N2O2S
Exact Mass 327.960682 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 5dScjGQPNaX
Name METHYL-3-(2-THIOMETHYL-6-TRICHLOROMETHYL-PYRIMIDIN-4-YL)-PROPANOATE
Compound Number 12
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C10H11Cl3N2O2S
InChI InChI=1S/C10H11Cl3N2O2S/c1-17-8(16)4-3-6-5-7(10(11,12)13)15-9(14-6)18-2/h5H,3-4H2,1-2H3
InChIKey SMSQAIVUSTWPIM-UHFFFAOYSA-N
Literature Reference Author A.F.C.FLORES,J.L.MALAVOLTA,A.A.SOUTO,R.B.GOULARTE,D.C.FLORES ,L.A.PIOVESAN
Literature Reference Citation J.BRAZ.CHEM.SOC.,24,580(2013)
Molecular Weight 329.629 g/mol
Source File Reference UWBT5145