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(1R,2S,5R,6S,8R,9S)-8-methylene-1,4,4-trimethyltricyclo[6.2.1.0(2,5)]undecane-6,9,12-triol
SpectraBase Compound ID B5uYxDMKG0F
InChI InChI=1S/C15H26O3/c1-13(2)4-9-12(13)10(17)5-15(8-16)7-14(9,3)6-11(15)18/h9-12,16-18H,4-8H2,1-3H3/t9-,10-,11-,12-,14-,15-/m0/s1
InChIKey HCEFLAKBDPUXNY-ZVOPPPCBSA-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 8fo8XRnqZDM
Name (1-R,2-S,5-R,6-S,8-R,9-S)-8-METHYLENE-1,4,4-TRIMETHYLTRICYCLO-[6.2.1.0-(2.5)]-UNDECANE-6,9,12-TRIOL
Compound Number 11
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C15H26O3
InChI InChI=1S/C15H26O3/c1-13(2)4-9-12(13)10(17)5-15(8-16)7-14(9,3)6-11(15)18/h9-12,16-18H,4-8H2,1-3H3/t9-,10-,11-,12-,14-,15-/m0/s1
InChIKey HCEFLAKBDPUXNY-ZVOPPPCBSA-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.,76,1016(2013)
Literature Reference DOI 10.1021/np3009013
Molecular Weight 254.370 g/mol
Sample ID 42570
Solvent CDCl3