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(5-S)-5-ACETOXYDEOXACAESPITOL
SpectraBase Compound ID FWXMhAijQPa
InChI InChI=1S/C17H27Br2ClO3/c1-10(21)22-12-9-16(4,20)14(19)8-11(12)17(5)7-6-13(18)15(2,3)23-17/h11-14H,6-9H2,1-5H3/t11-,12+,13+,14+,16+,17-/m0/s1
InChIKey FLSDGNYXFPEZAL-ZIQGKUQCSA-N
Mol Weight 474.66 g/mol
Molecular Formula C17H27Br2ClO3
Exact Mass 472.001548 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID AZqzodin64P
Name (5-S)-5-ACETOXYDEOXACAESPITOL
Compound Number 4
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C17H27Br2ClO3
InChI InChI=1S/C17H27Br2ClO3/c1-10(21)22-12-9-16(4,20)14(19)8-11(12)17(5)7-6-13(18)15(2,3)23-17/h11-14H,6-9H2,1-5H3/t11-,12+,13+,14+,16+,17-/m0/s1
InChIKey FLSDGNYXFPEZAL-ZIQGKUQCSA-N
Literature Reference Author C.JHULLIER,M.FALKENBERG,E.IOANNOU,A.QUESADA,P.PAPAZAFIRI,P.A .HORTA,E.P.SCHENKEL,
Literature Reference Citation J.NAT.PROD.,73,27(2010)
Literature Reference DOI 10.1021/np900627r
Molecular Weight 474.661 g/mol
Sample ID 34323
Solvent CDCl3