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NEGOMBATOPEROXIDE_C_METHYLESTER

View entire compound with spectra: 2 NMR

NEGOMBATOPEROXIDE_C_METHYLESTER
SpectraBase Compound ID BSqC7HfC8FX
InChI InChI=1S/C17H26O6/c1-12(15(19)20-4)13-6-10-17(3,23-22-13)9-5-8-16(2)11-7-14(18)21-16/h5,8,12-13H,6-7,9-11H2,1-4H3/b8-5+/t12-,13+,16?,17-/m1/s1
InChIKey MSLFGINWZMQBOO-KXGLNSIGSA-N
Mol Weight 326.39 g/mol
Molecular Formula C17H26O6
Exact Mass 326.172939 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 4miit4KbBvi
Name NEGOMBATOPEROXIDE_C_METHYLESTER
Compound Number 7A
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C17H26O6
InChI InChI=1S/C17H26O6/c1-12(15(19)20-4)13-6-10-17(3,23-22-13)9-5-8-16(2)11-7-14(18)21-16/h5,8,12-13H,6-7,9-11H2,1-4H3/b8-5+/t12-,13+,16?,17-/m1/s1
InChIKey MSLFGINWZMQBOO-KXGLNSIGSA-N
Literature Reference Author C.H.CHAO,K.J.CHOU,G.H.WANG,Y.C.WU,L.H.WANG,J.P.CHEN,J.H.SHEU ,P.J.SUNG
Literature Reference Citation J.NAT.PROD.,73,1538(2010)
Literature Reference DOI 10.1021/np100353x
Molecular Weight 326.390 g/mol
Sample ID 36347
Solvent CDCl3