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MOFLXDCCCUSZDY-PQGIWUCBSA-N
SpectraBase Compound ID 498qyFkQM4P
InChI InChI=1S/C29H34OS/c30-28-21-9-5-4-8-20-27(28)29(31-22-14-6-2-1-3-7-15-22)25-18-12-10-16-23(25)24-17-11-13-19-26(24)29/h6,10-19,27-28,30H,1-5,7-9,20-21H2/b14-6-,22-15+/t27-,28-/m0/s1
InChIKey MOFLXDCCCUSZDY-PQGIWUCBSA-N
Mol Weight 430.7 g/mol
Molecular Formula C29H34OS
Exact Mass 430.233037 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID Ega5Xe3b4Lz
Name MOFLXDCCCUSZDY-PQGIWUCBSA-N
Compound Number 6AB
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C29H34OS
InChI InChI=1S/C29H34OS/c30-28-21-9-5-4-8-20-27(28)29(31-22-14-6-2-1-3-7-15-22)25-18-12-10-16-23(25)24-17-11-13-19-26(24)29/h6,10-19,27-28,30H,1-5,7-9,20-21H2/b14-6-,22-15+/t27-,28-/m0/s1
InChIKey MOFLXDCCCUSZDY-PQGIWUCBSA-N
Literature Reference Author W.ADAM,S.G.BOSIO,B.FROEHLING,D.LEUSSER,D.STALKE
Literature Reference Citation J.AM.CHEM.SOC.,124,8316(2002)
Literature Reference DOI 10.1021/ja025934x
Molecular Weight 430.648 g/mol
Sample ID 34018
Solvent CDCl3