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(3AR*,6S*,6AR*)-6,6A-DIHYDRO-3A-HYDROXY-2,3-DIISOPROPOXY-4-METHOXY-5,6,6A-TRIMETHYL-1(3A-H)-PENTALENONE
SpectraBase Compound ID 5bsKTF9mqeo
InChI InChI=1S/C18H28O5/c1-9(2)22-13-14(19)17(7)12(6)11(5)15(21-8)18(17,20)16(13)23-10(3)4/h9-10,12,20H,1-8H3/t12?,17?,18-/m0/s1
InChIKey JONUXOLINZDCBQ-WQHGFJKVSA-N
Mol Weight 324.42 g/mol
Molecular Formula C18H28O5
Exact Mass 324.193674 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 4Xw2H9JHOvr
Name (3AR*,6S*,6AR*)-6,6A-DIHYDRO-3A-HYDROXY-2,3-DIISOPROPOXY-4-METHOXY-5,6,6A-TRIMETHYL-1(3A-H)-PENTALENONE
Compound Number 12
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C18H28O5
InChI InChI=1S/C18H28O5/c1-9(2)22-13-14(19)17(7)12(6)11(5)15(21-8)18(17,20)16(13)23-10(3)4/h9-10,12,20H,1-8H3/t12?,17?,18-/m0/s1
InChIKey JONUXOLINZDCBQ-WQHGFJKVSA-N
Literature Reference Author T.M.MORWICK,L.A.PAQUETTE
Literature Reference Citation J.ORG.CHEM.,62,627(1997)
Literature Reference DOI 10.1021/jo961945v
Molecular Weight 324.417 g/mol
Solvent C6D6
Source File Reference UWMS2991