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3-ACETYLVARODIOL;ENT-3-BETA-ACETOXY-12-ALPHA-HYDROXY-13-EPI-MANOYL-OXIDE
SpectraBase Compound ID CivaEoMVakI
InChI InChI=1S/C22H36O4/c1-8-21(6)17(24)13-16-20(5)11-10-18(25-14(2)23)19(3,4)15(20)9-12-22(16,7)26-21/h8,15-18,24H,1,9-13H2,2-7H3/t15-,16+,17-,18-,20-,21+,22+/m1/s1
InChIKey RQAKPAGNCKWNAV-LMIIEUPDSA-N
Mol Weight 364.5 g/mol
Molecular Formula C22H36O4
Exact Mass 364.26136 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 50KKKQ0kZYr
Name 3-ACETYLVARODIOL;ENT-3-BETA-ACETOXY-12-ALPHA-HYDROXY-13-EPI-MANOYL-OXIDE
Compound Number 12
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C22H36O4
InChI InChI=1S/C22H36O4/c1-8-21(6)17(24)13-16-20(5)11-10-18(25-14(2)23)19(3,4)15(20)9-12-22(16,7)26-21/h8,15-18,24H,1,9-13H2,2-7H3/t15-,16+,17-,18-,20-,21+,22+/m1/s1
InChIKey RQAKPAGNCKWNAV-LMIIEUPDSA-N
Literature Reference Author A.G.GRANADOS,M.B.JIMENEZ,A.MARTINEZ,A.PARRA,F.RIVAS,J.M.ARIA S
Literature Reference Citation PHYTOCHEM.,37,741(1994)
Literature Reference DOI 10.1016/S0031-9422(00)90350-9
Molecular Weight 364.525 g/mol
Solvent CDCl3
Source File Reference UWLU23438