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2,13-(2-THIAPROPANO)-DITHIENO-[3,2-E:3',2'-E']-BENZO-[1,2-B:4,3-B']-BIS-[1]-BENZOTHIOPHENE

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2,13-(2-THIAPROPANO)-DITHIENO-[3,2-E:3',2'-E']-BENZO-[1,2-B:4,3-B']-BIS-[1]-BENZOTHIOPHENE
SpectraBase Compound ID EmTyRZeIkJJ
InChI InChI=1S/2C24H12S5/c2*1-3-17-21-13-7-11(26-15(1)13)9-25-10-12-8-14-16(27-12)2-4-18-22(14)24-20(29-18)6-5-19(28-17)23(21)24/h2*1-8H,9-10H2
InChIKey DHYWRNCYTKHOPR-UHFFFAOYSA-N
Mol Weight 921.3 g/mol
Molecular Formula C48H24S10
Exact Mass 919.908513 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID KLQjAIyYr09
Name 2,13-(2-THIAPROPANO)-DITHIENO-[3,2-E:3',2'-E']-BENZO-[1,2-B:4,3-B']-BIS-[1]-BENZOTHIOPHENE
Compound Number 4
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C48H24S10
InChI InChI=1S/2C24H12S5/c2*1-3-17-21-13-7-11(26-15(1)13)9-25-10-12-8-14-16(27-12)2-4-18-22(14)24-20(29-18)6-5-19(28-17)23(21)24/h2*1-8H,9-10H2
InChIKey DHYWRNCYTKHOPR-UHFFFAOYSA-N
Literature Reference Author K.TANAKA,H.OSUGA,Y.KITAHARA
Literature Reference Citation J.ORG.CHEM.,67,1795(2002)
Literature Reference DOI 10.1021/jo016043v
Molecular Weight 921.319 g/mol
Solvent CDCl3
Source File Reference UWLU25458