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4-HYDROXY-3-(3,7-DIMETHYL-1-OXO)-2(Z),6-OCTADIENYLBENZOIC-ACID
SpectraBase Compound ID F8C5R3FLWO8
InChI InChI=1S/C17H20O4/c1-11(2)5-4-6-12(3)9-16(19)14-10-13(17(20)21)7-8-15(14)18/h5,7-10,18H,4,6H2,1-3H3,(H,20,21)/b12-9-
InChIKey MPPGIWBJWPIEDY-XFXZXTDPSA-N
Mol Weight 288.34 g/mol
Molecular Formula C17H20O4
Exact Mass 288.136159 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID HXqbJfDbNIx
Name 4-HYDROXY-(3',7'-DIMETHYL-1'-OXO-OCTA-(Z)-2',6'-DIENYL)-BENZOIC-ACID
Compound Number 3
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C17H20O4
InChI InChI=1S/C17H20O4/c1-11(2)5-4-6-12(3)9-16(19)14-10-13(17(20)21)7-8-15(14)18/h5,7-10,18H,4,6H2,1-3H3,(H,20,21)/b12-9-
InChIKey MPPGIWBJWPIEDY-XFXZXTDPSA-N
Literature Reference Author M.C.M.N.PUHL,D.A.G.CORTEZ,T.UEDA-NAKAMURA,B.P.D.FILHO
Literature Reference Citation MOLECULES,16,9925(2011)
Literature Reference DOI 10.3390/molecules16129925
Molecular Weight 288.343 g/mol
Sample ID 455
Solvent CDCl3