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(1S*,3R*,7R*,9S*,10S*,12R*,14R*)-10-HYDROXY-12-(2'-FORMYL)-ALLYL-7-METHYL-3-PENTYL-2,8,13-TRIOXATRICYCLO-[8.5.0.0(9,14)]-PENTADECANE
SpectraBase Compound ID K9sktq24Yq1
InChI InChI=1S/C22H36O5/c1-4-5-6-8-16-9-7-10-22(3)20(26-16)13-19-21(27-22)18(24)12-17(25-19)11-15(2)14-23/h14,16-21,24H,2,4-13H2,1,3H3/t16-,17-,18+,19-,20+,21+,22-/m1/s1
InChIKey QPJKBVOOKRBDJO-YSNDBMGOSA-N
Mol Weight 380.5 g/mol
Molecular Formula C22H36O5
Exact Mass 380.256274 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 68IC4hDPUI2
Name (1S*,3R*,7R*,9S*,10S*,12R*,14R*)-10-HYDROXY-12-(2'-FORMYL)-ALLYL-7-METHYL-3-PENTYL-2,8,13-TRIOXATRICYCLO-[8.5.0.0(9,14)]-PENTADECANE
Compound Number 2
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C22H36O5
InChI InChI=1S/C22H36O5/c1-4-5-6-8-16-9-7-10-22(3)20(26-16)13-19-21(27-22)18(24)12-17(25-19)11-15(2)14-23/h14,16-21,24H,2,4-13H2,1,3H3/t16-,17-,18+,19-,20+,21+,22-/m1/s1
InChIKey QPJKBVOOKRBDJO-YSNDBMGOSA-N
Literature Reference Author C.CRAWFORD,A.NELSON,I.PATEL
Literature Reference Citation ORG.LETTERS,8,4231(2006)
Literature Reference DOI 10.1021/ol0614323
Molecular Weight 380.525 g/mol
Sample ID 61467
Solvent CDCl3