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METHYL-12-OXO-8-ALPHA-HYDROXY-ABIET-13-EN-19-OATE
SpectraBase Compound ID 8hdRfe6rujD
InChI InChI=1S/C21H32O4/c1-13(2)14-12-21(24)10-7-16-19(3,17(21)11-15(14)22)8-6-9-20(16,4)18(23)25-5/h12-13,16-17,24H,6-11H2,1-5H3/t16-,17-,19+,20+,21+/m1/s1
InChIKey HDHZYDQBOSLOST-XPSJOHQASA-N
Mol Weight 348.5 g/mol
Molecular Formula C21H32O4
Exact Mass 348.23006 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID Iszdvwf0wei
Name METHYL-12-OXO-8-ALPHA-HYDROXY-ABIET-13-EN-19-OATE
Compound Number 2
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C21H32O4
InChI InChI=1S/C21H32O4/c1-13(2)14-12-21(24)10-7-16-19(3,17(21)11-15(14)22)8-6-9-20(16,4)18(23)25-5/h12-13,16-17,24H,6-11H2,1-5H3/t16-,17-,19+,20+,21+/m1/s1
InChIKey HDHZYDQBOSLOST-XPSJOHQASA-N
Literature Reference Author A.F.BARRERO,J.F.Q.D.MORAL,M.M.HERRADOR,M.AKSSIRA,A.BENNAMARA ,S.AKKAD,M.AITIGRI
Literature Reference Citation PHYTOCHEM.,65,2507(2004)
Literature Reference DOI 10.1016/j.phytochem.2004.07.021
Molecular Weight 348.483 g/mol
Solvent CDCl3
Source File Reference UWLU32934