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ETHYL-(6AR,7AR,8AS,9AR)-REL-6A,7,7A,8A,9,9A-HEXAHYDRO-7A,8A-DIMETHYL-6-OXO-5,8-DIOXACYCLOPROPA-[B]-PHENANTRENE-6A(6H)-CARBOXYLATE

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ETHYL-(6AR,7AR,8AS,9AR)-REL-6A,7,7A,8A,9,9A-HEXAHYDRO-7A,8A-DIMETHYL-6-OXO-5,8-DIOXACYCLOPROPA-[B]-PHENANTRENE-6A(6H)-CARBOXYLATE
SpectraBase Compound ID 8j6OJvE5MNv
InChI InChI=1S/C18H20O5/c1-4-21-14(19)18-10-17(3)16(2,23-17)9-12(18)11-7-5-6-8-13(11)22-15(18)20/h5-8,12H,4,9-10H2,1-3H3/t12-,16+,17-,18-/m0/s1
InChIKey FHAXVNOTHILLIL-LSZYVWPRSA-N
Mol Weight 316.35 g/mol
Molecular Formula C18H20O5
Exact Mass 316.131074 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID G1PjUlQWMRo
Name ETHYL-(6AR,7AR,8AS,9AR)-REL-6A,7,7A,8A,9,9A-HEXAHYDRO-7A,8A-DIMETHYL-6-OXO-5,8-DIOXACYCLOPROPA-[B]-PHENANTRENE-6A(6H)-CARBOXYLATE
Compound Number 11A
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C18H20O5
InChI InChI=1S/C18H20O5/c1-4-21-14(19)18-10-17(3)16(2,23-17)9-12(18)11-7-5-6-8-13(11)22-15(18)20/h5-8,12H,4,9-10H2,1-3H3/t12-,16+,17-,18-/m0/s1
InChIKey FHAXVNOTHILLIL-LSZYVWPRSA-N
Literature Reference Author I.Y.FLORES-LARIOS,L.LOPEZ-GARRIDO,F.J.MARTINEZ-MARTINEZ,J.GO NZALEZ,E.V.GARCIA-BA
Literature Reference Citation MOLECULES,15,1513(2010)
Literature Reference DOI 10.3390/molecules15031513
Molecular Weight 316.354 g/mol
Sample ID 70181
Solvent CDCl3