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4-BENZYL-5-ISOPROPYL-1,3-DIHYDROIMIDAZOLE-2-THIONE
SpectraBase Compound ID 1DndfdKtreE
InChI InChI=1S/C13H16N2S/c1-9(2)12-11(14-13(16)15-12)8-10-6-4-3-5-7-10/h3-7,9H,8H2,1-2H3,(H2,14,15,16)
InChIKey QKIHTFGTYBKANQ-UHFFFAOYSA-N
Mol Weight 232.34 g/mol
Molecular Formula C13H16N2S
Exact Mass 232.10342 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID IAVNXp41mQ5
Name 4-BENZYL-5-ISOPROPYL-1,3-DIHYDROIMIDAZOLE-2-THIONE
Compound Number 7D
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C13H16N2S
InChI InChI=1S/C13H16N2S/c1-9(2)12-11(14-13(16)15-12)8-10-6-4-3-5-7-10/h3-7,9H,8H2,1-2H3,(H2,14,15,16)
InChIKey QKIHTFGTYBKANQ-UHFFFAOYSA-N
Literature Reference Author Y.M.LOKSHA,P.T.JORGENSEN,E.B.PEDERSEN,M.A.EL-BADAWI,A.A.EL-B ARBARY,C.NIELSEN
Literature Reference Citation J.HETCYCL.CHEM.,39,375(2002)
Literature Reference DOI 10.1002/jhet.5570390222
Molecular Weight 232.343 g/mol
Solvent DMSO-D6
Source File Reference UWSI8644