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WRLHRCDNZRVPBS-GQHWJEKJSA-N
SpectraBase Compound ID 6ifkAW3yGhR
InChI InChI=1S/C24H33F3N2OS/c1-18(2)21(22(24(25,26)27)28-31(30)23(3,4)5)29(16-19-12-8-6-9-13-19)17-20-14-10-7-11-15-20/h6-15,18,21-22,28H,16-17H2,1-5H3/t21-,22+,31?/m1/s1
InChIKey WRLHRCDNZRVPBS-GQHWJEKJSA-N
Mol Weight 454.6 g/mol
Molecular Formula C24H33F3N2OS
Exact Mass 454.226569 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 224e5C35RqR
Name WRLHRCDNZRVPBS-GQHWJEKJSA-N
Compound Number 3E
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C24H33F3N2OS
InChI InChI=1S/C24H33F3N2OS/c1-18(2)21(22(24(25,26)27)28-31(30)23(3,4)5)29(16-19-12-8-6-9-13-19)17-20-14-10-7-11-15-20/h6-15,18,21-22,28H,16-17H2,1-5H3/t21-,22+,31?/m1/s1
InChIKey WRLHRCDNZRVPBS-GQHWJEKJSA-N
Literature Reference Author G.K.S.PRAKASH,M.MANDAL
Literature Reference Citation J.AM.CHEM.SOC.,124,6538(2002)
Literature Reference DOI 10.1021/ja020482+
Molecular Weight 454.594 g/mol
Sample ID 50000
Solvent CDCl3