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(3R,4R,5S)-3-[(11E)-hexadeca-11,15-dien-7,9-diynyl]-4-hydroxy-5-methyloxolan-2-one
SpectraBase Compound ID 2mH0CBsld74
InChI InChI=1S/C21H28O3/c1-3-4-5-6-7-8-9-10-11-12-13-14-15-16-17-19-20(22)18(2)24-21(19)23/h3,6-7,18-20,22H,1,4-5,12-17H2,2H3/b7-6+/t18-,19+,20-/m0/s1
InChIKey BWHZURYINQNHCL-RGOVZJGCSA-N
Mol Weight 328.45 g/mol
Molecular Formula C21H28O3
Exact Mass 328.203845 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID GAbkOPsOQWA
Name (3R,4R,5S)-3-[(11E)-hexadeca-11,15-dien-7,9-diynyl]-4-hydroxy-5-methyloxolan-2-one
Compound Number (3'*R,4'*R,5'*S)-#A6
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C21H28O3
InChI InChI=1S/C21H28O3/c1-3-4-5-6-7-8-9-10-11-12-13-14-15-16-17-19-20(22)18(2)24-21(19)23/h3,6-7,18-20,22H,1,4-5,12-17H2,2H3/b7-6+/t18-,19+,20-/m0/s1
InChIKey BWHZURYINQNHCL-RGOVZJGCSA-N
Literature Reference Author M.LORENZO,I.BRITO,M.CUETO,L.D.CROZ,J.DARIAS
Literature Reference Citation ORG.LETTERS,8,5001(2006)
Literature Reference DOI 10.1021/ol061572c
Molecular Weight 328.452 g/mol
Sample ID 61918
Solvent CDCl3