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#11B;(18R,19R)-18-[(2-R)-1,4-DIOXASPIRO-[4.5]-DECANYL]-19-FLUORO-4-METHYL-17-OXA-4,14,21-TRIAZAHEXACYCLO-[19.6.1.1(7,14).0(2,6).0(8,13).0(22,27)]-NONACOSA-1(28
SpectraBase Compound ID ARYYgASXSmW
InChI InChI=1S/C34H34FN3O5/c1-36-32(39)29-23-17-37(26-11-5-3-9-21(23)26)15-16-41-31(28-20-42-34(43-28)13-7-2-8-14-34)25(35)19-38-18-24(30(29)33(36)40)22-10-4-6-12-27(22)38/h3-6,9-12,17-18,25,28,31H,2,7-8,13-16,19-20H2,1H3/t25-,28-,31+/m1/s1
InChIKey KUEDZIFTCCMSEI-DERQMEARSA-N
Mol Weight 583.7 g/mol
Molecular Formula C34H34FN3O5
Exact Mass 583.248249 g/mol

19F Nuclear Magnetic Resonance (NMR) Chemical Shifts

19F Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID DWn86hbpqMG
Name #11B;(18R,19R)-18-[(2-R)-1,4-DIOXASPIRO-[4.5]-DECANYL]-19-FLUORO-4-METHYL-17-OXA-4,14,21-TRIAZAHEXACYCLO-[19.6.1.1(7,14).0(2,6).0(8,13).0(22,27)]-NONACOSA-1(28
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C34H34FN3O5
InChI InChI=1S/C34H34FN3O5/c1-36-32(39)29-23-17-37(26-11-5-3-9-21(23)26)15-16-41-31(28-20-42-34(43-28)13-7-2-8-14-34)25(35)19-38-18-24(30(29)33(36)40)22-10-4-6-12-27(22)38/h3-6,9-12,17-18,25,28,31H,2,7-8,13-16,19-20H2,1H3/t25-,28-,31+/m1/s1
InChIKey KUEDZIFTCCMSEI-DERQMEARSA-N
Literature Reference Author P.G.GOEKJIAN,G.Z.WU,S.CHEN,L.ZHOU,M.R.JIROUSEK,J.R.GILLIG,L. M.BALLAS,J.T.DIXON
Literature Reference Citation J.ORG.CHEM.,64,4238(1999)
Literature Reference DOI 10.1021/jo9808876
Solvent CDCl3
Source File Reference UWSI41108