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JCTPJDVTOJJNKF-SBPNQFBHSA-N

View entire compound with spectra: 1 NMR

JCTPJDVTOJJNKF-SBPNQFBHSA-N
SpectraBase Compound ID 2iITAtunjrJ
InChI InChI=1S/C40H40N2O8S/c1-27-24-41(39(45)42(37(27)43)38(44)28-11-7-5-8-12-28)36-23-34(48-26-51-4)35(50-36)25-49-40(29-13-9-6-10-14-29,30-15-19-32(46-2)20-16-30)31-17-21-33(47-3)22-18-31/h5-22,24,34-36H,23,25-26H2,1-4H3/t34-,35+,36+/m1/s1
InChIKey JCTPJDVTOJJNKF-SBPNQFBHSA-N
Mol Weight 708.8 g/mol
Molecular Formula C40H40N2O8S
Exact Mass 708.250537 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 1zVdnXLYNF9
Name JCTPJDVTOJJNKF-SBPNQFBHSA-N
Compound Number 6
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C40H40N2O8S
InChI InChI=1S/C40H40N2O8S/c1-27-24-41(39(45)42(37(27)43)38(44)28-11-7-5-8-12-28)36-23-34(48-26-51-4)35(50-36)25-49-40(29-13-9-6-10-14-29,30-15-19-32(46-2)20-16-30)31-17-21-33(47-3)22-18-31/h5-22,24,34-36H,23,25-26H2,1-4H3/t34-,35+,36+/m1/s1
InChIKey JCTPJDVTOJJNKF-SBPNQFBHSA-N
Literature Reference Author G.H.VEENEMAN,G.A.VANDERMAREL,H.VANDENELST,J.H.VANBOOM
Literature Reference Citation REC.TR.CH.P.-B.,109,449(1990)
Molecular Weight 708.826 g/mol
Solvent Unknown
Source File Reference UWTS2384