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4-(THIOPHEN-2-YL)-2-PARA-TOLYL-3,4-DIHYDRO-2H-BENZO-[H]-CHROMENE-5,6-DIONE;SYN/ANTI-ISOMERS
SpectraBase Compound ID 4rewyTWBUnL
InChI InChI=1S/2C24H18O3S/c2*1-14-8-10-15(11-9-14)19-13-18(20-7-4-12-28-20)21-23(26)22(25)16-5-2-3-6-17(16)24(21)27-19/h2*2-12,18-19H,13H2,1H3/t18-,19+;18-,19-/m11/s1
InChIKey ONYHCIZHYZXHOZ-MHPDFVICSA-N
Mol Weight 772.93 g/mol
Molecular Formula C48H36O6S2
Exact Mass 772.195331 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID BgeCvjkGJE2
Name 4-(THIOPHEN-2-YL)-2-PARA-TOLYL-3,4-DIHYDRO-2H-BENZO-[H]-CHROMENE-5,6-DIONE;SYN/ANTI-ISOMERS
Compound Number 11F
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C48H36O6S2
InChI InChI=1S/2C24H18O3S/c2*1-14-8-10-15(11-9-14)19-13-18(20-7-4-12-28-20)21-23(26)22(25)16-5-2-3-6-17(16)24(21)27-19/h2*2-12,18-19H,13H2,1H3/t18-,19+;18-,19-/m11/s1
InChIKey ONYHCIZHYZXHOZ-MHPDFVICSA-N
Literature Reference Author F.D.C.D.SILVA,S.B.FERREIRA,C.R.KAISER,A.C.PINTO,V.F.FERREIRA
Literature Reference Citation J.BRAZ.CHEM.SOC.,20,1478(2009)
Literature Reference DOI 10.1590/s0103-50532009000800014
Molecular Weight 772.930 g/mol
Source File Reference UWBT6254