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5-(2-ACETOXY-7-HYDROXY-8-OXOTRIDECYL)-RESORCINOL
SpectraBase Compound ID 13W0HAovres
InChI InChI=1S/C21H32O6/c1-3-4-5-9-20(25)21(26)10-7-6-8-19(27-15(2)22)13-16-11-17(23)14-18(24)12-16/h11-12,14,19,21,23-24,26H,3-10,13H2,1-2H3
InChIKey QMJQLLLAVKGPQF-UHFFFAOYSA-N
Mol Weight 380.5 g/mol
Molecular Formula C21H32O6
Exact Mass 380.219889 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID Gj3hEjWBAzc
Name 5-(2-ACETOXY-7-HYDROXY-8-OXOTRIDECYL)-RESORCINOL
Compound Number 2
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C21H32O6
InChI InChI=1S/C21H32O6/c1-3-4-5-9-20(25)21(26)10-7-6-8-19(27-15(2)22)13-16-11-17(23)14-18(24)12-16/h11-12,14,19,21,23-24,26H,3-10,13H2,1-2H3
InChIKey QMJQLLLAVKGPQF-UHFFFAOYSA-N
Literature Reference Author A.F.BARRERO,M.M.HERRADOR,P.ARTEAGA,I.RODRIGUEZ-GARCIA,M.GARC IA-MORENO
Literature Reference Citation J.NAT.PROD.,60,65(1997)
Literature Reference DOI 10.1021/np960402d
Molecular Weight 380.481 g/mol
Solvent ACETONE-D6
Source File Reference UWCP120