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3-(4-Formyl-8,12-dimethyl-3(Z),7(E),11-tridecatrienyl)-2,5-dihydro-2-hydroxy-5-oxo-furane
SpectraBase Compound ID Ek9Ogz9x70E
InChI InChI=1S/C20H28O4/c1-15(2)7-4-8-16(3)9-5-10-17(14-21)11-6-12-18-13-19(22)24-20(18)23/h7,9,11,13-14,20,23H,4-6,8,10,12H2,1-3H3/b16-9+,17-11+
InChIKey QANSOLURXRZERC-BTMZFSHUSA-N
Mol Weight 332.44 g/mol
Molecular Formula C20H28O4
Exact Mass 332.198759 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID KvHo0UCF1sn
Name 3-(4-Formyl-8,12-dimethyl-3(Z),7(E),11-tridecatrienyl)-2,5-dihydro-2-hydroxy-5-oxo-furane
Comments reassigned
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Formula C20H28O4
InChI InChI=1S/C20H28O4/c1-15(2)7-4-8-16(3)9-5-10-17(14-21)11-6-12-18-13-19(22)24-20(18)23/h7,9,11,13-14,20,23H,4-6,8,10,12H2,1-3H3/b16-9+,17-11+
InChIKey QANSOLURXRZERC-BTMZFSHUSA-N
Instrument Name SF = 300 MHz
Literature Reference L.J. Reynolds, B.P. Morgan, G.A.Hite, J. Am. Chem. Soc. 110, 5172 (1988).
NMR Standard TMS
Origin Chemical Concepts. A Wiley Division. Weinheim, Germany
Solvent CDCl3