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OGBRLLSSNWERII-BJQOMGFOSA-N
SpectraBase Compound ID 1guCWpqaUub
InChI InChI=1S/C21H30N2O5S2/c1-15(2)30(27,28)23-13-16(3)17-5-7-18(8-6-17)19-9-11-20(12-10-19)21(24)14-22-29(4,25)26/h5-12,15-16,21-24H,13-14H2,1-4H3/t16-,21?/m0/s1
InChIKey OGBRLLSSNWERII-BJQOMGFOSA-N
Mol Weight 454.6 g/mol
Molecular Formula C21H30N2O5S2
Exact Mass 454.159614 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID AuzjnkZGczT
Name OGBRLLSSNWERII-BJQOMGFOSA-N
Compound Number M9
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C21H30N2O5S2
InChI InChI=1S/C21H30N2O5S2/c1-15(2)30(27,28)23-13-16(3)17-5-7-18(8-6-17)19-9-11-20(12-10-19)21(24)14-22-29(4,25)26/h5-12,15-16,21-24H,13-14H2,1-4H3/t16-,21?/m0/s1
InChIKey OGBRLLSSNWERII-BJQOMGFOSA-N
Literature Reference Author M.ZMIJEWSKI,T.A.GILLESPIE,D.A.JACKSON,D.F.SCHMIDT,P.YI,P.KUL ANTHAIVEL
Literature Reference Citation DRUG.MET.DISP.,34,925(2006)
Molecular Weight 454.600 g/mol
Source File Reference UWLU74230