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(1R*,1'S*,3'AR*,5R*,6R*,8R*,8'AS*)-3-OXO-8-(1',4',4'-TRIMETHYL-8'-METHYLENEDECAHYDROAZULEN-1'-YL)-2,7-DIOXABICYCLO-[3.2.1]-OCT-6-YL-ACETATE;(APLYVIOLENE)
SpectraBase Compound ID EqmvgSgbUhd
InChI InChI=1S/C22H32O5/c1-12-7-6-9-21(3,4)15-8-10-22(5,17(12)15)18-14-11-16(24)26-20(18)27-19(14)25-13(2)23/h14-15,17-20H,1,6-11H2,2-5H3/t14-,15-,17-,18-,19-,20+,22-/m1/s1
InChIKey KUMXKDACHVUJFQ-LZZVWXGSSA-N
Mol Weight 376.5 g/mol
Molecular Formula C22H32O5
Exact Mass 376.224974 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 2rNGbvb4xFw
Name (1R*,1'S*,3'AR*,5R*,6R*,8R*,8'AS*)-3-OXO-8-(1',4',4'-TRIMETHYL-8'-METHYLENEDECAHYDROAZULEN-1'-YL)-2,7-DIOXABICYCLO-[3.2.1]-OCT-6-YL-ACETATE;(APLYVIOLENE)
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C22H32O5
InChI InChI=1S/C22H32O5/c1-12-7-6-9-21(3,4)15-8-10-22(5,17(12)15)18-14-11-16(24)26-20(18)27-19(14)25-13(2)23/h14-15,17-20H,1,6-11H2,2-5H3/t14-,15-,17-,18-,19-,20+,22-/m1/s1
InChIKey KUMXKDACHVUJFQ-LZZVWXGSSA-N
Literature Reference Author T.W.HAMBLEY,A.POINER,W.C.TAYLOR
Literature Reference Citation AUSTR.J.CHEM.,43,1861(1990)
Literature Reference DOI 10.1071/ch9901861
Molecular Weight 376.493 g/mol
Solvent C6D6
Source File Reference UWED6801