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2-[3-(4-CHLOROPHENYL)-THIOUREIDO]-4,5,6,7-TETRAHYDROBENZO-[B]-THIOPHENE-3-CARBOXYLIC-ACID-ETHYLESTER
SpectraBase Compound ID HMXe97wNM0P
InChI InChI=1S/C18H19ClN2O2S2/c1-2-23-17(22)15-13-5-3-4-6-14(13)25-16(15)21-18(24)20-12-9-7-11(19)8-10-12/h7-10H,2-6H2,1H3,(H2,20,21,24)
InChIKey LSRZSDKWRMQECX-UHFFFAOYSA-N
Mol Weight 394.94 g/mol
Molecular Formula C18H19ClN2O2S2
Exact Mass 394.057648 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID oHrPFexXw5
Name 2-[3-(4-CHLOROPHENYL)-THIOUREIDO]-4,5,6,7-TETRAHYDROBENZO-[B]-THIOPHENE-3-CARBOXYLIC-ACID-ETHYLESTER
Compound Number 21
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C18H19ClN2O2S2
InChI InChI=1S/C18H19ClN2O2S2/c1-2-23-17(22)15-13-5-3-4-6-14(13)25-16(15)21-18(24)20-12-9-7-11(19)8-10-12/h7-10H,2-6H2,1H3,(H2,20,21,24)
InChIKey LSRZSDKWRMQECX-UHFFFAOYSA-N
Literature Reference Author K.M.AL-TAISAN,H.M.A.AL-HAZIMI,S.S.AL-SHIHRY
Literature Reference Citation MOLECULES,15,3932(2010)
Literature Reference DOI 10.3390/molecules15063932
Molecular Weight 394.934 g/mol
Sample ID 70966
Solvent CDCl3