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TRIS-TTF

View entire compound with spectra: 1 NMR

TRIS-TTF
SpectraBase Compound ID 4KfeopTuu5y
InChI InChI=1S/C44H56S18/c1-7-11-15-23-47-35-36(48-24-16-12-8-2)60-41(59-35)39-51-27-29(53-39)19-21-31-32(56-43(55-31)44-57-33(45-5)34(46-6)58-44)22-20-30-28-52-40(54-30)42-61-37(49-25-17-13-9-3)38(62-42)50-26-18-14-10-4/h19-22,27-28H,7-18,23-26H2,1-6H3/b21-19+,22-20+
InChIKey ZIQSLXFXPRLXTL-FLFKKZLDSA-N
Mol Weight 1162.0 g/mol
Molecular Formula C44H56S18
Exact Mass 1159.935483 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 59S3qBzEDCu
Name TRIS-TTF
Compound Number 2B
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C44H56S18
InChI InChI=1S/C44H56S18/c1-7-11-15-23-47-35-36(48-24-16-12-8-2)60-41(59-35)39-51-27-29(53-39)19-21-31-32(56-43(55-31)44-57-33(45-5)34(46-6)58-44)22-20-30-28-52-40(54-30)42-61-37(49-25-17-13-9-3)38(62-42)50-26-18-14-10-4/h19-22,27-28H,7-18,23-26H2,1-6H3/b21-19+,22-20+
InChIKey ZIQSLXFXPRLXTL-FLFKKZLDSA-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 1162.009 g/mol
Sample ID 38723
Solvent CDCl3