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GAUDICHAUDIANIC-ACID;(2S)-2-METHYL-2-(4'-METHYL-3'-PENTENYL)-8-(3''-METHYL-2-BUTENYL)-2H-1-BENZOPYRAN-6-CARBOXYLIC-ACID
SpectraBase Compound ID Ayqr1OHMWwB
InChI InChI=1S/C22H28O3/c1-15(2)7-6-11-22(5)12-10-18-14-19(21(23)24)13-17(20(18)25-22)9-8-16(3)4/h7-8,10,12-14H,6,9,11H2,1-5H3,(H,23,24)
InChIKey TXHBNVYFCZMCPB-UHFFFAOYSA-N
Mol Weight 340.46 g/mol
Molecular Formula C22H28O3
Exact Mass 340.203845 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 1Akoc9pHXSg
Name GAUDICHAUDIANIC-ACID;(2S)-2-METHYL-2-(4'-METHYL-3'-PENTENYL)-8-(3''-METHYL-2-BUTENYL)-2H-1-BENZOPYRAN-6-CARBOXYLIC-ACID
Compound Number 1
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C22H28O3
InChI InChI=1S/C22H28O3/c1-15(2)7-6-11-22(5)12-10-18-14-19(21(23)24)13-17(20(18)25-22)9-8-16(3)4/h7-8,10,12-14H,6,9,11H2,1-5H3,(H,23,24)
InChIKey TXHBNVYFCZMCPB-UHFFFAOYSA-N
Literature Reference Author A.A.LOPES,D.C.BALDOQUI,S.N.LOPEZ,M.J.KATO,V.D.S.BOLZANI,M.FU RLAN
Literature Reference Citation PHYTOCHEM.,68,2053(2007)
Literature Reference DOI 10.1016/j.phytochem.2007.04.025
Molecular Weight 340.463 g/mol
Sample ID 63028
Solvent CDCl3