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(+)-(2S,3S)-3-(4-BROMOBENZOYLOXYMETHYL)-1,1-DIFLUORO-2-(4-METHOXYPHENYLAMINO)-CYCLOPENTANE
SpectraBase Compound ID 4treUWojgqR
InChI InChI=1S/C20H20BrF2NO3/c1-26-17-8-6-16(7-9-17)24-18-14(10-11-20(18,22)23)12-27-19(25)13-2-4-15(21)5-3-13/h2-9,14,18,24H,10-12H2,1H3/t14-,18+/m1/s1
InChIKey VIORULTUOWZXQF-KDOFPFPSSA-N
Mol Weight 440.28 g/mol
Molecular Formula C20H20BrF2NO3
Exact Mass 439.059463 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID J92SLYHTAtG
Name (+)-(2S,3S)-3-(4-BROMOBENZOYLOXYMETHYL)-1,1-DIFLUORO-2-(4-METHOXYPHENYLAMINO)-CYCLOPENTANE
Compound Number 14
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C20H20BrF2NO3
InChI InChI=1S/C20H20BrF2NO3/c1-26-17-8-6-16(7-9-17)24-18-14(10-11-20(18,22)23)12-27-19(25)13-2-4-15(21)5-3-13/h2-9,14,18,24H,10-12H2,1H3/t14-,18+/m1/s1
InChIKey VIORULTUOWZXQF-KDOFPFPSSA-N
Literature Reference Author S.FUSTERO,M.SANCHEZ-ROSELLO,J.F.SANZ-CERVERA,J.L.ACENA,C.D.P OZO,B.FERNANDEZ,A.BA
Literature Reference Citation ORG.LETTERS,8,4633(2006)
Literature Reference DOI 10.1021/ol061892w
Molecular Weight 440.285 g/mol
Sample ID 61700
Solvent CDCl3