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HUMIFUSANE-A;(1R,9S,11R)-6-CARBONYL-5(Z),7(Z)-DIONE-12-HYDROXYL-CARYOPHLLANE
SpectraBase Compound ID C27aQ86fkrk
InChI InChI=1S/C15H22O2/c1-10-4-5-14-13(8-15(14,3)9-16)11(2)7-12(17)6-10/h6-7,13-14,16H,4-5,8-9H2,1-3H3/b10-6-,11-7-/t13-,14-,15+/m1/s1
InChIKey XODSQTHHYAFFDA-HEEWFMTISA-N
Mol Weight 234.34 g/mol
Molecular Formula C15H22O2
Exact Mass 234.16198 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 2Zjlf24GiXE
Name HUMIFUSANE-A;(1R,9S,11R)-6-CARBONYL-5(Z),7(Z)-DIONE-12-HYDROXYL-CARYOPHLLANE
Compound Number 1
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C15H22O2
InChI InChI=1S/C15H22O2/c1-10-4-5-14-13(8-15(14,3)9-16)11(2)7-12(17)6-10/h6-7,13-14,16H,4-5,8-9H2,1-3H3/b10-6-,11-7-/t13-,14-,15+/m1/s1
InChIKey XODSQTHHYAFFDA-HEEWFMTISA-N
Literature Reference Author Y.TIAN,L.M.SUN,B.LI,X.Q.LIU,J.X.DONG
Literature Reference Citation FITOTERAPIA,82,251(2011)
Literature Reference DOI 10.1016/j.fitote.2010.10.005
Molecular Weight 234.338 g/mol
Solvent CD3OD
Source File Reference UWDB1197