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TOPSENTOLIDE_B3

View entire compound with spectra: 1 NMR

TOPSENTOLIDE_B3
SpectraBase Compound ID HHH8YU5kzt9
InChI InChI=1S/C20H32O4/c1-2-3-4-5-6-10-13-18(21)19(22)16-15-17-12-9-7-8-11-14-20(23)24-17/h6-7,9-10,15-19,21-22H,2-5,8,11-14H2,1H3/b9-7-,10-6-,16-15+/t17-,18-,19-/m0/s1
InChIKey MDCUPALPRUQMSF-JQGBYENFSA-N
Mol Weight 336.5 g/mol
Molecular Formula C20H32O4
Exact Mass 336.23006 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID GndpmIKWJYG
Name TOPSENTOLIDE_B3
Compound Number 5
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C20H32O4
InChI InChI=1S/C20H32O4/c1-2-3-4-5-6-10-13-18(21)19(22)16-15-17-12-9-7-8-11-14-20(23)24-17/h6-7,9-10,15-19,21-22H,2-5,8,11-14H2,1H3/b9-7-,10-6-,16-15+/t17-,18-,19-/m0/s1
InChIKey MDCUPALPRUQMSF-JQGBYENFSA-N
Literature Reference Author X.LUO,F.LI,J.HONG,C.O.LEE,C.J.SIM,K.S.IM,J.H.JUNG
Literature Reference Citation J.NAT.PROD.,69,567(2006)
Literature Reference DOI 10.1021/np0503552
Molecular Weight 336.472 g/mol
Solvent CD3OD
Source File Reference UWMZ18179