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ULSABIXTPINMNX-ADGSLESKSA-N
SpectraBase Compound ID HAbROHQ7tTa
InChI InChI=1S/C25H35F3N2OS/c1-19(2)16-22(23(25(26,27)28)29-32(31)24(3,4)5)30(17-20-12-8-6-9-13-20)18-21-14-10-7-11-15-21/h6-15,19,22-23,29H,16-18H2,1-5H3/t22-,23-,32?/m1/s1
InChIKey ULSABIXTPINMNX-ADGSLESKSA-N
Mol Weight 468.6 g/mol
Molecular Formula C25H35F3N2OS
Exact Mass 468.242219 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 38Mzc1dfVdr
Name ULSABIXTPINMNX-ADGSLESKSA-N
Compound Number 3D
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C25H35F3N2OS
InChI InChI=1S/C25H35F3N2OS/c1-19(2)16-22(23(25(26,27)28)29-32(31)24(3,4)5)30(17-20-12-8-6-9-13-20)18-21-14-10-7-11-15-21/h6-15,19,22-23,29H,16-18H2,1-5H3/t22-,23-,32?/m1/s1
InChIKey ULSABIXTPINMNX-ADGSLESKSA-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 468.621 g/mol
Sample ID 49999
Solvent CDCl3