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2-(1'-Oxo-dodeca-pentaenyl)-1,3,5-trihydroxy-benzene
SpectraBase Compound ID Jsmbf325dUA
InChI InChI=1S/C26H34O4/c1-2-3-4-5-6-7-8-9-10-11-12-13-14-15-16-17-18-19-23(28)26-24(29)20-22(27)21-25(26)30/h3-4,6-7,9-10,12-13,15-16,20-21,27,29-30H,2,5,8,11,14,17-19H2,1H3/b4-3-,7-6-,10-9-,13-12-,16-15-
InChIKey JGENOJYUFVSJRO-JLNKQSITSA-N
Mol Weight 410.6 g/mol
Molecular Formula C26H34O4
Exact Mass 410.24571 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID hJDondW4Ck
Name 2-(1'-Oxo-dodeca-pentaenyl)-1,3,5-trihydroxy-benzene
CAS Registry Number 79553-90-5
Comments reassigned
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Formula C26H34O4
InChI InChI=1S/C26H34O4/c1-2-3-4-5-6-7-8-9-10-11-12-13-14-15-16-17-18-19-23(28)26-24(29)20-22(27)21-25(26)30/h3-4,6-7,9-10,12-13,15-16,20-21,27,29-30H,2,5,8,11,14,17-19H2,1H3/b4-3-,7-6-,10-9-,13-12-,16-15-
InChIKey JGENOJYUFVSJRO-JLNKQSITSA-N
Literature Reference W. Gerwick, W. Fenical, Phytochem. 21, 633 (1982).
NMR Standard TMS
Origin Chemical Concepts. A Wiley Division. Weinheim, Germany
Solvent CDCl3