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9-BETA-(3-METHYL-PENTOYL-3-ENE)-PARTHENOLIDE
SpectraBase Compound ID 4GMAp0uQxsx
InChI InChI=1S/C21H28O5/c1-6-12(2)10-17(22)24-16-11-15-14(4)20(23)25-18(15)19-21(5,26-19)9-7-8-13(16)3/h6,8,15-16,18-19H,4,7,9-11H2,1-3,5H3/b12-6+,13-8+/t15-,16-,18-,19-,21+/m0/s1
InChIKey ASELCIPDGVTGCJ-AVQJDTQASA-N
Mol Weight 360.45 g/mol
Molecular Formula C21H28O5
Exact Mass 360.193674 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID HoFbJPK2xNr
Name 9-BETA-(3-METHYL-PENTOYL-3-ENE)-PARTHENOLIDE
Compound Number 5
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C21H28O5
InChI InChI=1S/C21H28O5/c1-6-12(2)10-17(22)24-16-11-15-14(4)20(23)25-18(15)19-21(5,26-19)9-7-8-13(16)3/h6,8,15-16,18-19H,4,7,9-11H2,1-3,5H3/b12-6+,13-8+/t15-,16-,18-,19-,21+/m0/s1
InChIKey ASELCIPDGVTGCJ-AVQJDTQASA-N
Literature Reference Author A.A.AHMED,A.E.H.H.MOHAMED,O.TZAKOU,A.PETROPOULOU,M.E.HASSAN, M.A.EL-MAGHRABY,K.P.
Literature Reference Citation PHYTOCHEM.,62,1191(2003)
Literature Reference DOI 10.1016/S0031-9422(02)00478-8
Molecular Weight 360.450 g/mol
Solvent CHCl3
Source File Reference UWLU29613