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9'-cis-19'-Butanoyloxy-fucoxanthin
SpectraBase Compound ID L6IUi0mL97s
InChI InChI=1S/C46H64O8/c1-12-17-41(50)52-31-36(24-25-40-42(6,7)28-38(53-35(5)47)29-44(40,10)51)23-16-21-33(3)19-14-13-18-32(2)20-15-22-34(4)39(49)30-46-43(8,9)26-37(48)27-45(46,11)54-46/h13-16,18-24,37-38,48,51H,12,17,26-31H2,1-11H3/b14-13-,20-15-,21-16-,32-18-,33-19+,34-22-,36-23-
InChIKey NEKQVGDUHFTLGS-HSBWIIFMSA-N
Mol Weight 745.0 g/mol
Molecular Formula C46H64O8
Exact Mass 744.460119 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID BTP2mXXJ2L4
Name 9'-cis-19'-Butanoyloxy-fucoxanthin
Copyright Copyright © 2002-2024 Wiley-VCH Verlag GmbH & Co. KGaA. All Rights Reserved.
Formula C46H64O8
InChI InChI=1S/C46H64O8/c1-12-17-41(50)52-31-36(24-25-40-42(6,7)28-38(53-35(5)47)29-44(40,10)51)23-16-21-33(3)19-14-13-18-32(2)20-15-22-34(4)39(49)30-46-43(8,9)26-37(48)27-45(46,11)54-46/h13-16,18-24,37-38,48,51H,12,17,26-31H2,1-11H3/b14-13-,20-15-,21-16-,32-18-,33-19+,34-22-,36-23-
InChIKey NEKQVGDUHFTLGS-HSBWIIFMSA-N
Instrument Name Bruker AM-400
Literature Reference G. Engler, T. Bjornland, S. Liaaen-Jensen, Magn. Res. Chem. 28, 519 (1990).
NMR Standard TMS
Origin Chemical Concepts. A Wiley Division. Weinheim, Germany
Solvent not reported