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2-[2-(1,3,3-TRIMETHYL-1,3-DIHYDRO-2H-[1]-BENZOTHIENO-[3,2-B]-PYRROL-2-YLIDEN)-ETHYLIDENE]-1-BENZOTHIOPHEN-3-ONE
SpectraBase Compound ID 4D9iUgqOCk2
InChI InChI=1S/C23H19NOS2/c1-23(2)19(13-12-18-21(25)15-9-5-7-11-17(15)26-18)24(3)20-14-8-4-6-10-16(14)27-22(20)23/h4-13H,1-3H3/b18-12-,19-13-
InChIKey NHDPJBVLVZRLPT-BKHHGCLFSA-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 6XzVYHBD8MW
Name 2-[2-(1,3,3-TRIMETHYL-1,3-DIHYDRO-2H-[1]-BENZOTHIENO-[3,2-B]-PYRROL-2-YLIDEN)-ETHYLIDENE]-1-BENZOTHIOPHEN-3-ONE
Compound Number 5
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)19(13-12-18-21(25)15-9-5-7-11-17(15)26-18)24(3)20-14-8-4-6-10-16(14)27-22(20)23/h4-13H,1-3H3/b18-12-,19-13-
InChIKey NHDPJBVLVZRLPT-BKHHGCLFSA-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 33536
Solvent DMSO-D6:CF3COOD=98:2