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OROPHEIC_ACID;OCTADECA-17-EN-9,11,13-TRIYNOIC_ACID
SpectraBase Compound ID 1rNdZr7k94O
InChI InChI=1S/C18H22O2/c1-2-3-4-5-6-7-8-9-10-11-12-13-14-15-16-17-18(19)20/h2H,1,3-4,11-17H2,(H,19,20)
InChIKey YESBZXSFUYCBEH-UHFFFAOYSA-N
Mol Weight 270.37 g/mol
Molecular Formula C18H22O2
Exact Mass 270.16198 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 400jaff2cpY
Name OROPHEIC_ACID;OCTADECA-17-EN-9,11,13-TRIYNOIC_ACID
Compound Number 5
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C18H22O2
InChI InChI=1S/C18H22O2/c1-2-3-4-5-6-7-8-9-10-11-12-13-14-15-16-17-18(19)20/h2H,1,3-4,11-17H2,(H,19,20)
InChIKey YESBZXSFUYCBEH-UHFFFAOYSA-N
Literature Reference Author A.CAVIN,O.POTTERAT,J.L.WOLFENDER,K.HOSTETTMANN,W.DYATMYKO
Literature Reference Citation J.NAT.PROD.,61,1497(1998)
Literature Reference DOI 10.1021/np980203p
Molecular Weight 270.371 g/mol
Solvent CD3OD
Source File Reference UWRJ91