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2-(4-ACETYLBENZYLTHIO)-6-(3,5-DIFLUOROBENZYL)-URACIL
SpectraBase Compound ID 76B3HmVp4yB
InChI InChI=1S/C20H16F2N2O2S/c1-12(25)15-4-2-13(3-5-15)11-27-20-23-18(10-19(26)24-20)8-14-6-16(21)9-17(22)7-14/h2-7,9-10H,8,11H2,1H3,(H,23,24,26)
InChIKey HFVQCPSFSGGWKP-UHFFFAOYSA-N
Mol Weight 386.42 g/mol
Molecular Formula C20H16F2N2O2S
Exact Mass 386.090055 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID LkrtG2sbeLt
Name 2-(4-ACETYLBENZYLTHIO)-6-(3,5-DIFLUOROBENZYL)-URACIL
Compound Number 7I
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C20H16F2N2O2S
InChI InChI=1S/C20H16F2N2O2S/c1-12(25)15-4-2-13(3-5-15)11-27-20-23-18(10-19(26)24-20)8-14-6-16(21)9-17(22)7-14/h2-7,9-10H,8,11H2,1H3,(H,23,24,26)
InChIKey HFVQCPSFSGGWKP-UHFFFAOYSA-N
Literature Reference Author L.ZHANG,X.TANG,Y.CAO,S.WU,Y.ZHANG,J.ZHAO,Y.GUO,C.TIAN,Z.ZHAN G,J.LIU,X.WANG
Literature Reference Citation MOLECULES,19,7104(2014)
Literature Reference DOI 10.3390/molecules19067104
Molecular Weight 386.416 g/mol
Solvent DMSO-D6
Source File Reference UWIR15013