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WTDJEOXCDHKWLZ-SRVKXCTJSA-N

View entire compound with spectra: 1 NMR

WTDJEOXCDHKWLZ-SRVKXCTJSA-N
SpectraBase Compound ID LYnUq1OXNSp
InChI InChI=1S/C24H24N6O9S3/c31-16(32)4-1-10-22-28-14(7-40-22)20(38)26-12(3-6-18(35)36)24-30-15(9-42-24)21(39)27-11(2-5-17(33)34)23-29-13(8-41-23)19(37)25-10/h7-12H,1-6H2,(H,25,37)(H,26,38)(H,27,39)(H,31,32)(H,33,34)(H,35,36)/t10-,11-,12-/m0/s1
InChIKey WTDJEOXCDHKWLZ-SRVKXCTJSA-N
Mol Weight 636.67 g/mol
Molecular Formula C24H24N6O9S3
Exact Mass 636.07669 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 5cAaKuSKRVe
Name WTDJEOXCDHKWLZ-SRVKXCTJSA-N
Compound Number 4
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C24H24N6O9S3
InChI InChI=1S/C24H24N6O9S3/c31-16(32)4-1-10-22-28-14(7-40-22)20(38)26-12(3-6-18(35)36)24-30-15(9-42-24)21(39)27-11(2-5-17(33)34)23-29-13(8-41-23)19(37)25-10/h7-12H,1-6H2,(H,25,37)(H,26,38)(H,27,39)(H,31,32)(H,33,34)(H,35,36)/t10-,11-,12-/m0/s1
InChIKey WTDJEOXCDHKWLZ-SRVKXCTJSA-N
Literature Reference Author Y.SINGH,N.SOKOLENKO,M.J.KELSO,L.R.GAHAN,G.ABBENANTE,D.P.FAIR LIE
Literature Reference Citation J.AM.CHEM.SOC.,123,333(2001)
Literature Reference DOI 10.1021/ja002666z
Molecular Weight 636.669 g/mol
Solvent DMSO-D6
Source File Reference UWVN28573