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METHYL-3-ALPHA-HYDROXY-7-OXO-DEHYDROABIETATE
SpectraBase Compound ID BndmPKDDML8
InChI InChI=1S/C21H28O4/c1-12(2)13-6-7-15-14(10-13)16(22)11-17-20(15,3)9-8-18(23)21(17,4)19(24)25-5/h6-7,10,12,17-18,23H,8-9,11H2,1-5H3/t17-,18-,20-,21-/m1/s1
InChIKey NGQOYIBROVRKQB-VURPSTOHSA-N
Mol Weight 344.45 g/mol
Molecular Formula C21H28O4
Exact Mass 344.198759 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 44Q1yZhLgX6
Name METHYL-3-ALPHA-HYDROXY-7-OXO-DEHYDROABIETATE
Compound Number 1
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C21H28O4
InChI InChI=1S/C21H28O4/c1-12(2)13-6-7-15-14(10-13)16(22)11-17-20(15,3)9-8-18(23)21(17,4)19(24)25-5/h6-7,10,12,17-18,23H,8-9,11H2,1-5H3/t17-,18-,20-,21-/m1/s1
InChIKey NGQOYIBROVRKQB-VURPSTOHSA-N
Literature Reference Author J.C.VARDAMIDES,E.DONGO,A.E.NKENGFACK,Z.T.FOMUM,T.M.NGANDO,B. VOGLER,W.KRAUS
Literature Reference Citation FITOTERAPIA,72,386(2001)
Literature Reference DOI 10.1016/S0367-326X(00)00341-5
Molecular Weight 344.451 g/mol
Solvent CDCl3
Source File Reference UWVN4028