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BIS-TTF

View entire compound with spectra: 1 NMR

BIS-TTF
SpectraBase Compound ID 8ivruSC3jwr
InChI InChI=1S/C39H50S15/c1-5-9-13-21-41-31-32(42-22-14-10-6-2)52-37(51-31)35-45-25-27(47-35)17-19-29-30(50-39(40)49-29)20-18-28-26-46-36(48-28)38-53-33(43-23-15-11-7-3)34(54-38)44-24-16-12-8-4/h17-20,25-26H,5-16,21-24H2,1-4H3/b19-17+,20-18+
InChIKey YQIJAWWSORDSSK-XPWSMXQVSA-N
Mol Weight 999.7 g/mol
Molecular Formula C39H50S15
Exact Mass 997.972319 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 13CvV2omK87
Name BIS-TTF
Compound Number 1
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C39H50S15
InChI InChI=1S/C39H50S15/c1-5-9-13-21-41-31-32(42-22-14-10-6-2)52-37(51-31)35-45-25-27(47-35)17-19-29-30(50-39(40)49-29)20-18-28-26-46-36(48-28)38-53-33(43-23-15-11-7-3)34(54-38)44-24-16-12-8-4/h17-20,25-26H,5-16,21-24H2,1-4H3/b19-17+,20-18+
InChIKey YQIJAWWSORDSSK-XPWSMXQVSA-N
Literature Reference Author N.GAUTIER,R.SAMUEL,Y.SAHIN,E.LEVILLAIN,S.LEROY-LHEZ,P.HUDHOM ME
Literature Reference Citation ORG.LETTERS,6,1569(2004)
Literature Reference DOI 10.1021/ol049620l
Molecular Weight 999.726 g/mol
Sample ID 38722
Solvent CDCl3