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2-[2-(1,2,2-TRIMETHYL-1,2-DIHYDRO-3H-[1]-BENZOTHIENO-[3,2-B]-PYRROL-3-YLIDEN)-ETHYLIDENE]-1-BENZOTHIOPHEN-3-ONE
SpectraBase Compound ID DhKMbEMTKbg
InChI InChI=1S/C23H19NOS2/c1-23(2)16(12-13-19-21(25)15-9-5-7-11-18(15)26-19)22-20(24(23)3)14-8-4-6-10-17(14)27-22/h4-13H,1-3H3/b16-12+,19-13-
InChIKey IVDHTHKQLVSCQK-UBSBAQTRSA-N
Mol Weight 389.53 g/mol
Molecular Formula C23H19NOS2
Exact Mass 389.090807 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID DtZNzZcvC3N
Name 2-[2-(1,2,2-TRIMETHYL-1,2-DIHYDRO-3H-[1]-BENZOTHIENO-[3,2-B]-PYRROL-3-YLIDEN)-ETHYLIDENE]-1-BENZOTHIOPHEN-3-ONE
Compound Number 6
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C23H19NOS2
InChI InChI=1S/C23H19NOS2/c1-23(2)16(12-13-19-21(25)15-9-5-7-11-18(15)26-19)22-20(24(23)3)14-8-4-6-10-17(14)27-22/h4-13H,1-3H3/b16-12+,19-13-
InChIKey IVDHTHKQLVSCQK-UBSBAQTRSA-N
Literature Reference Author A.A.SHIMKIN,V.Z.SHIRINIAN,D.M.NIKALIN,M.M.KRAYUSHKIN,T.S.PIV INA,N.A.TROITSKY,L.G
Literature Reference Citation EUR.J.ORG.CHEM.,2087(2006)
Literature Reference DOI 10.1002/ejoc.200500912
Molecular Weight 389.530 g/mol
Sample ID 33537
Solvent DMSO-D6:CF3COOH