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PWGVATPLHZJPFD-WHLIWEHUSA-N
SpectraBase Compound ID HHGzWAFlInW
InChI InChI=1S/C26H30O7S2/c1-26(2,3)16-31-25(34)35-19-15-30-24(29-4)21(33-23(28)18-13-9-6-10-14-18)20(19)32-22(27)17-11-7-5-8-12-17/h5-14,19-21,24H,15-16H2,1-4H3/t19-,20+,21-,24+/m1/s1
InChIKey PWGVATPLHZJPFD-WHLIWEHUSA-N
Mol Weight 518.64 g/mol
Molecular Formula C26H30O7S2
Exact Mass 518.143296 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID HxCte40qMQK
Name PWGVATPLHZJPFD-WHLIWEHUSA-N
Compound Number 15
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C26H30O7S2
InChI InChI=1S/C26H30O7S2/c1-26(2,3)16-31-25(34)35-19-15-30-24(29-4)21(33-23(28)18-13-9-6-10-14-18)20(19)32-22(27)17-11-7-5-8-12-17/h5-14,19-21,24H,15-16H2,1-4H3/t19-,20+,21-,24+/m1/s1
InChIKey PWGVATPLHZJPFD-WHLIWEHUSA-N
Literature Reference Author B.QUICLET-SIRE,S.Z.ZARD
Literature Reference Citation J.AM.CHEM.SOC.,118,9190(1996)
Literature Reference DOI 10.1021/ja9619622
Molecular Weight 518.640 g/mol
Sample ID 36187
Solvent Unknown