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EZETIMIBE;(3-R,4-S)-1-(4-FLUOROMETHYL)-3[(S)-3-(4-FLUOROPHENYL)-3-HYDROXYPROPYL]-4-(4-HYDROXYPHENYL)-AZETRIDIN-2-ONE
SpectraBase Compound ID CIQZFJGp47i
InChI InChI=1S/C24H21F2NO3/c25-17-5-1-15(2-6-17)22(29)14-13-21-23(16-3-11-20(28)12-4-16)27(24(21)30)19-9-7-18(26)8-10-19/h1-12,21-23,28-29H,13-14H2/t21-,22+,23-/m1/s1
InChIKey OLNTVTPDXPETLC-XPWALMASSA-N
Mol Weight 409.43 g/mol
Molecular Formula C24H21F2NO3
Exact Mass 409.14895 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID G4qO9Pc4vSV
Name EZETIMIBE;(3-R,4-S)-1-(4-FLUOROMETHYL)-3[(S)-3-(4-FLUOROPHENYL)-3-HYDROXYPROPYL]-4-(4-HYDROXYPHENYL)-AZETRIDIN-2-ONE
Compound Number 1
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C24H21F2NO3
InChI InChI=1S/C24H21F2NO3/c25-17-5-1-15(2-6-17)22(29)14-13-21-23(16-3-11-20(28)12-4-16)27(24(21)30)19-9-7-18(26)8-10-19/h1-12,21-23,28-29H,13-14H2/t21-,22+,23-/m1/s1
InChIKey OLNTVTPDXPETLC-XPWALMASSA-N
Literature Reference Author Z.SANTA,J.KOTI,K.SZOEKE,K.VUKICS,C.SZANTAY
Literature Reference Citation J.PHARM.BIOM.ANAL.,58,125(2012)
Literature Reference DOI 10.1016/j.jpba.2011.08.041
Molecular Weight 409.432 g/mol
Solvent DMSO-D6
Source File Reference UWMZ44011