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(1R,3E,7E,11S,12S)-17-ACETOXY-14-OXO-3,7,18-DOLABELLATRIENE
SpectraBase Compound ID K6S0xP7tOa7
InChI InChI=1S/C22H32O3/c1-15(2)19-13-21(24)22(5)12-11-16(3)7-6-8-18(9-10-20(19)22)14-25-17(4)23/h8,11,19-20H,1,6-7,9-10,12-14H2,2-5H3/b16-11+,18-8-/t19-,20+,22-/m1/s1
InChIKey LLUBOAZYNSNZAB-BJJPSBNCSA-N
Mol Weight 344.5 g/mol
Molecular Formula C22H32O3
Exact Mass 344.235145 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID KRVP4izLsZ4
Name (1R,3E,7E,11S,12S)-17-ACETOXY-14-OXO-3,7,18-DOLABELLATRIENE
Compound Number 6
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C22H32O3
InChI InChI=1S/C22H32O3/c1-15(2)19-13-21(24)22(5)12-11-16(3)7-6-8-18(9-10-20(19)22)14-25-17(4)23/h8,11,19-20H,1,6-7,9-10,12-14H2,2-5H3/b16-11+,18-8-/t19-,20+,22-/m1/s1
InChIKey LLUBOAZYNSNZAB-BJJPSBNCSA-N
Literature Reference Author E.IOANNOU,A.QUESADA,M.M.RAHMAN,S.GIBBONS,C.VAGIAS,V.ROUSSIS
Literature Reference Citation EUR.J.ORG.CHEM.,2012,5177(2012)
Literature Reference DOI 10.1002/ejoc.201200533
Molecular Weight 344.494 g/mol
Solvent CDCl3
Source File Reference UWLU84063