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(S)-(10E,12E)-14-HYDROXY-9-OXO-10,12-OCATDECADIENOIC-ACID;PORRIGENIC-ACID
SpectraBase Compound ID DJgADfV8z8b
InChI InChI=1S/C18H30O4/c1-2-3-11-16(19)13-9-10-14-17(20)12-7-5-4-6-8-15-18(21)22/h9-10,13-14,16,19H,2-8,11-12,15H2,1H3,(H,21,22)/b13-9+,14-10+/t16-/m0/s1
InChIKey GDCBVHSUEZTUIW-NRJQCZOGSA-N
Mol Weight 310.43 g/mol
Molecular Formula C18H30O4
Exact Mass 310.214409 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 6EEEAYM4KSQ
Name (S)-(10E,12E)-14-HYDROXY-9-OXO-10,12-OCATDECADIENOIC-ACID;PORRIGENIC-ACID
Compound Number 1
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C18H30O4
InChI InChI=1S/C18H30O4/c1-2-3-11-16(19)13-9-10-14-17(20)12-7-5-4-6-8-15-18(21)22/h9-10,13-14,16,19H,2-8,11-12,15H2,1H3,(H,21,22)/b13-9+,14-10+/t16-/m0/s1
InChIKey GDCBVHSUEZTUIW-NRJQCZOGSA-N
Literature Reference Author T.HASEGAWA,M.ISHIBASHI,T.TAKATA,F.TAKANO,T.OHTA
Literature Reference Citation CHEM.PHARM.BULL.,55,1748(2007)
Literature Reference DOI 10.1248/cpb.55.1748
Molecular Weight 310.434 g/mol
Sample ID 56051
Solvent CD3OD