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NA-BOC-6-TRIFLUOROACETYL-5,6-DIDEHYDROTETRAHYDROALSTONINE
SpectraBase Compound ID 2QgxThwg57A
InChI InChI=1S/C28H29F3N2O6/c1-14-17-11-32-12-18(24(34)28(29,30)31)22-15-8-6-7-9-20(15)33(26(36)39-27(2,3)4)23(22)21(32)10-16(17)19(13-38-14)25(35)37-5/h6-9,12-14,16-17,21H,10-11H2,1-5H3/t14-,16-,17-,21-/m0/s1
InChIKey BKYDUTGFOWPJFS-MEOSDYHSSA-N
Mol Weight 546.54 g/mol
Molecular Formula C28H29F3N2O6
Exact Mass 546.197771 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 71LswOb1TLi
Name NA-BOC-6-TRIFLUOROACETYL-5,6-DIDEHYDROTETRAHYDROALSTONINE
Compound Number 6
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C28H29F3N2O6
InChI InChI=1S/C28H29F3N2O6/c1-14-17-11-32-12-18(24(34)28(29,30)31)22-15-8-6-7-9-20(15)33(26(36)39-27(2,3)4)23(22)21(32)10-16(17)19(13-38-14)25(35)37-5/h6-9,12-14,16-17,21H,10-11H2,1-5H3/t14-,16-,17-,21-/m0/s1
InChIKey BKYDUTGFOWPJFS-MEOSDYHSSA-N
Literature Reference Author M.HALONEN,R.JOKELA,M.LOUNASMAA
Literature Reference Citation HETEROCYCLES,41,353(1995)
Literature Reference DOI 10.3987/COM-94-6960
Molecular Weight 546.543 g/mol
Solvent CDCl3
Source File Reference UWCP5720