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ERYTHRO-N,N-DIBUTYL-2-FLUORO-3-HYDROXY-3-PHENYL-2-(TRIFLUOROMETHYL)-PROPANAMIDE
SpectraBase Compound ID F5aLA07AKfM
InChI InChI=1S/2C18H25F4NO2/c2*1-3-5-12-23(13-6-4-2)16(25)17(19,18(20,21)22)15(24)14-10-8-7-9-11-14/h2*7-11,15,24H,3-6,12-13H2,1-2H3/t2*15-,17+/m00/s1
InChIKey URFBBUUBEOLTJV-UKQKDSIYSA-N
Mol Weight 726.79 g/mol
Molecular Formula C36H50F8N2O4
Exact Mass 726.364283 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 4QqCWmYTPwA
Name ERYTHRO-N,N-DIBUTYL-2-FLUORO-3-HYDROXY-3-PHENYL-2-(TRIFLUOROMETHYL)-PROPANAMIDE
Compound Number 4BA
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C36H50F8N2O4
InChI InChI=1S/2C18H25F4NO2/c2*1-3-5-12-23(13-6-4-2)16(25)17(19,18(20,21)22)15(24)14-10-8-7-9-11-14/h2*7-11,15,24H,3-6,12-13H2,1-2H3/t2*15-,17+/m00/s1
InChIKey URFBBUUBEOLTJV-UKQKDSIYSA-N
Literature Reference Author K.SATO,T.SEKIGUCHI,T.ISHIHARA,T.KONNO,H.YAMANAKA
Literature Reference Citation J.ORG.CHEM.,69,5041(2004)
Literature Reference DOI 10.1021/jo0358729
Molecular Weight 726.791 g/mol
Solvent CDCl3
Source File Reference UWVN22080