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(R)-1-(3,5-Bis(trifluoromethyl)phenyl)-3-(1-cyclopropylethyl)thiourea
SpectraBase Compound ID Ciunhe5XBPi
InChI InChI=1S/C14H14F6N2S/c1-7(8-2-3-8)21-12(23)22-11-5-9(13(15,16)17)4-10(6-11)14(18,19)20/h4-8H,2-3H2,1H3,(H2,21,22,23)/t7-/m1/s1
InChIKey UMKBCVRLYFHCAD-SSDOTTSWSA-N
Mol Weight 356.33 g/mol
Molecular Formula C14H14F6N2S
Exact Mass 356.078189 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 1C9dZ9E7Bk0
Name (R)-1-[3,5-BIS-(TRIFLUOROMETHYL)-PHENYL]-3-(1-CYCLOPROPYLETHYL)-THIOUREA
Compound Number 9J
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C14H14F6N2S
InChI InChI=1S/C14H14F6N2S/c1-7(8-2-3-8)21-12(23)22-11-5-9(13(15,16)17)4-10(6-11)14(18,19)20/h4-8H,2-3H2,1H3,(H2,21,22,23)/t7-/m1/s1
InChIKey UMKBCVRLYFHCAD-SSDOTTSWSA-N
Literature Reference Author S.BRAESE,N.VOLZ,F.GLAESER,M.NIEGER
Literature Reference Citation BEIL.J.ORG.CHEM.,8,1385(2012)
Literature Reference DOI 10.3762/bjoc.8.160
Molecular Weight 356.329 g/mol
Solvent CDCl3
Source File Reference UWIR11067