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5-BENZOYL-4-HYDROXY-4-TRIFLUOROMETHYL-6-PHENYLHEXAHYDRO-PYRIMIDIN-2-THIONE
SpectraBase Compound ID JDUNvhyJB06
InChI InChI=1S/C18H15F3N2O2S/c19-18(20,21)17(25)13(15(24)12-9-5-2-6-10-12)14(22-16(26)23-17)11-7-3-1-4-8-11/h1-10,13-14,25H,(H2,22,23,26)/t13-,14+,17-/m1/s1
InChIKey IIVSGLAGBKLNIF-JKIFEVAISA-N
Mol Weight 380.39 g/mol
Molecular Formula C18H15F3N2O2S
Exact Mass 380.080633 g/mol

19F Nuclear Magnetic Resonance (NMR) Chemical Shifts

19F Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID FXfseO2VDa4
Name 5-BENZOYL-4-HYDROXY-4-TRIFLUOROMETHYL-6-PHENYLHEXAHYDRO-PYRIMIDIN-2-THIONE
Compound Number VIF
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C18H15F3N2O2S
InChI InChI=1S/C18H15F3N2O2S/c19-18(20,21)17(25)13(15(24)12-9-5-2-6-10-12)14(22-16(26)23-17)11-7-3-1-4-8-11/h1-10,13-14,25H,(H2,22,23,26)/t13-,14+,17-/m1/s1
InChIKey IIVSGLAGBKLNIF-JKIFEVAISA-N
Literature Reference Author Y.V.BURGART,O.G.KUZUEVA,M.V.PRYADEINA,C.O.KAPPE,V.I.SALOUTIN
Literature Reference Citation RUSS.J.ORG.CHEM.,37,869(2001)
Literature Reference DOI 10.1023/A:1012473901354
Solvent C6F6
Source File Reference UWVN5524