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(2R,5S,8R,9R)-Isocaryolane-5,8,9-triol
SpectraBase Compound ID CgE7Hazp1mp
InChI InChI=1S/C15H26O3/c1-12(2)8-10-13(3)5-4-11(16)14(17,9-13)6-7-15(10,12)18/h10-11,16-18H,4-9H2,1-3H3/t10-,11-,13+,14-,15+/m1/s1
InChIKey PKSBUYLQJCALRI-NXRJPMIISA-N
Mol Weight 254.37 g/mol
Molecular Formula C15H26O3
Exact Mass 254.188195 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID Fja3I3QeZ9j
Name (2-R,5-S,8-R,9-R)-ISOCARYOLANE-5,8,9-TRIOL
Compound Number 10
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C15H26O3
InChI InChI=1S/C15H26O3/c1-12(2)8-10-13(3)5-4-11(16)14(17,9-13)6-7-15(10,12)18/h10-11,16-18H,4-9H2,1-3H3/t10-,11-,13+,14-,15+/m1/s1
InChIKey PKSBUYLQJCALRI-NXRJPMIISA-N
Literature Reference Author J.ASCARI,M.A.D.BOAVENTURA,J.A.TAKAHASHI,R.DURAN-PATRON,R.HER NANDEZ-GALAN,A.J.MAC
Literature Reference Citation J.NAT.PROD.,74,1707(2011)
Literature Reference DOI 10.1021/np1009465
Molecular Weight 254.370 g/mol
Sample ID 39092
Solvent CDCl3