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2-HYDROXY-CALAMENENE-14-OL
SpectraBase Compound ID 3BKA9OplXko
InChI InChI=1S/2C15H22O2/c2*1-9(2)12-5-4-11(8-16)13-7-15(17)10(3)6-14(12)13/h2*6-7,9,11-12,16-17H,4-5,8H2,1-3H3/t2*11-,12-/m00/s1
InChIKey WWUSUSUEMAELSO-KDLZNPCISA-N
Mol Weight 468.68 g/mol
Molecular Formula C30H44O4
Exact Mass 468.32396 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID IoYkwAeYcRL
Name 2-HYDROXY-CALAMENENE-14-OL
Compound Number 5
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C30H44O4
InChI InChI=1S/2C15H22O2/c2*1-9(2)12-5-4-11(8-16)13-7-15(17)10(3)6-14(12)13/h2*6-7,9,11-12,16-17H,4-5,8H2,1-3H3/t2*11-,12-/m00/s1
InChIKey WWUSUSUEMAELSO-KDLZNPCISA-N
Literature Reference Author M.MORIMOTO,C.L.CANTRELL,L.LIBOUS-BAILEY,S.O.DUKE
Literature Reference Citation PHYTOCHEM.,70,69(2009)
Literature Reference DOI 10.1016/j.phytochem.2008.09.026
Molecular Weight 468.677 g/mol
Sample ID 63901
Solvent CDCl3