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4-O-ACETYL-HYGROPHORONE-D-(12);TRANS-4-ACETOXY-5-HYDROXY-5-TRIDECANOYL-2-CYCLOPENTEN-1-ONE
SpectraBase Compound ID 5IiYa9cRc5A
InChI InChI=1S/C20H32O5/c1-3-4-5-6-7-8-9-10-11-12-13-17(22)20(24)18(23)14-15-19(20)25-16(2)21/h14-15,19,24H,3-13H2,1-2H3/t19-,20-/m1/s1
InChIKey NTQWRCCBLDPDFL-WOJBJXKFSA-N
Mol Weight 352.5 g/mol
Molecular Formula C20H32O5
Exact Mass 352.224974 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID BYk53mB3LCz
Name 4-O-ACETYL-HYGROPHORONE-D-(12);TRANS-4-ACETOXY-5-HYDROXY-5-TRIDECANOYL-2-CYCLOPENTEN-1-ONE
Compound Number 19
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C20H32O5
InChI InChI=1S/C20H32O5/c1-3-4-5-6-7-8-9-10-11-12-13-17(22)20(24)18(23)14-15-19(20)25-16(2)21/h14-15,19,24H,3-13H2,1-2H3/t19-,20-/m1/s1
InChIKey NTQWRCCBLDPDFL-WOJBJXKFSA-N
Literature Reference Author T.LUEBKEN,J.SCHMIDT,A.PORZEL,N.ARNOLD,L.WESSJOHANN
Literature Reference Citation PHYTOCHEM.,65,1061(2004)
Literature Reference DOI 10.1016/j.phytochem.2004.01.023
Molecular Weight 352.471 g/mol
Solvent CDCl3
Source File Reference UWVN31283