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(+)-(5-R*,10-R*)-5-METHOXYCEMBRA-1-E,3-E,7-E,11-Z,15-PENTAEN-20,10-OLIDE
SpectraBase Compound ID CDLS4WELG2v
InChI InChI=1S/C21H30O3/c1-14(2)17-8-7-16(4)20(23-5)11-6-15(3)12-19-13-18(10-9-17)21(22)24-19/h6-8,13-14,19-20H,9-12H2,1-5H3/b15-6+,16-7+,17-8+/t19-,20-/m1/s1
InChIKey NDOJFBJQGLEMIG-PVHWGTCTSA-N
Mol Weight 330.47 g/mol
Molecular Formula C21H30O3
Exact Mass 330.219495 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID AlNttuT9P6I
Name (+)-(5-R*,10-R*)-5-METHOXYCEMBRA-1-E,3-E,7-E,11-Z,15-PENTAEN-20,10-OLIDE
Compound Number 7
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C21H30O3
InChI InChI=1S/C21H30O3/c1-14(2)17-8-7-16(4)20(23-5)11-6-15(3)12-19-13-18(10-9-17)21(22)24-19/h6-8,13-14,19-20H,9-12H2,1-5H3/b15-6+,16-7+,17-8+/t19-,20-/m1/s1
InChIKey NDOJFBJQGLEMIG-PVHWGTCTSA-N
Literature Reference Author M.K.LANGAT,N.R.CROUCH,P.J.SMITH,D.A.MULHOLLAND
Literature Reference Citation J.NAT.PROD.,74,2349(2011)
Literature Reference DOI 10.1021/np2002012
Molecular Weight 330.467 g/mol
Sample ID 39518
Solvent CDCl3