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6-OXO-12-PEROXYABIETA-8,11,13-TRIENE

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6-OXO-12-PEROXYABIETA-8,11,13-TRIENE
SpectraBase Compound ID HHrAxhMMhEu
InChI InChI=1S/C20H28O3/c1-12(2)14-9-13-10-16(21)18-19(3,4)7-6-8-20(18,5)15(13)11-17(14)23-22/h9,11-12,18,22H,6-8,10H2,1-5H3/t18?,20-/m1/s1
InChIKey KIHIETVOAQUNLR-ROPPNANJSA-N
Mol Weight 316.44 g/mol
Molecular Formula C20H28O3
Exact Mass 316.203845 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID FuFbzzUfdeK
Name 6-OXO-12-PEROXYABIETA-8,11,13-TRIENE
Compound Number 2
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C20H28O3
InChI InChI=1S/C20H28O3/c1-12(2)14-9-13-10-16(21)18-19(3,4)7-6-8-20(18,5)15(13)11-17(14)23-22/h9,11-12,18,22H,6-8,10H2,1-5H3/t18?,20-/m1/s1
InChIKey KIHIETVOAQUNLR-ROPPNANJSA-N
Literature Reference Author A.ULUBELEN,N.TAN,U.SOENMEZ,G.TOPCU
Literature Reference Citation PHYTOCHEM.,47,899(1998)
Literature Reference DOI 10.1016/S0031-9422(97)00540-2
Molecular Weight 316.441 g/mol
Solvent CDCl3
Source File Reference UWMS411