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4-AMINO-1-(3,3-DIFLUORO-2-HYDROXYMETHYL-TETRAHYDRO-THIOPHEN-2-YL)-1H-PYRIMIDIN-2-ONE
SpectraBase Compound ID EzjwLjvIlJf
InChI InChI=1S/C9H11F2N3O2S/c10-8(11)2-4-17-9(8,5-15)14-3-1-6(12)13-7(14)16/h1,3,15H,2,4-5H2,(H2,12,13,16)
InChIKey GQXWHGBSKCJVES-UHFFFAOYSA-N
Mol Weight 263.26 g/mol
Molecular Formula C9H11F2N3O2S
Exact Mass 263.054004 g/mol

19F Nuclear Magnetic Resonance (NMR) Chemical Shifts

19F Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID GxauP6s9ma8
Name 4-AMINO-1-(3,3-DIFLUORO-2-HYDROXYMETHYL-TETRAHYDRO-THIOPHEN-2-YL)-1H-PYRIMIDIN-2-ONE
Compound Number 34
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C9H11F2N3O2S
InChI InChI=1S/C9H11F2N3O2S/c10-8(11)2-4-17-9(8,5-15)14-3-1-6(12)13-7(14)16/h1,3,15H,2,4-5H2,(H2,12,13,16)
InChIKey GQXWHGBSKCJVES-UHFFFAOYSA-N
Literature Reference Author X.ZHANG,H.XIA,X.DONG,J.JIN,W.D.MENG,F.L.QING
Literature Reference Citation J.ORG.CHEM.,68,9026(2003)
Literature Reference DOI 10.1021/jo034512i
Solvent DMSO-D6
Source File Reference UWVN25699