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Valepotriat iodohydrine

View entire compound with spectra: 1 NMR

Valepotriat iodohydrine
SpectraBase Compound ID CzH0UPBtw2i
InChI InChI=1S/C25H37IO9/c1-14(2)7-19(27)34-18-9-17-16(11-32-21(29)10-24(5,6)30)12-33-23(22(17)25(18,31)13-26)35-20(28)8-15(3)4/h9,12,14-15,18,22-23,30-31H,7-8,10-11,13H2,1-6H3
InChIKey HBZBTGAKGOIOAD-UHFFFAOYSA-N
Mol Weight 608.5 g/mol
Molecular Formula C25H37IO9
Exact Mass 608.148228 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID CuSvUuiD2oX
Name Valepotriat iodohydrine
Copyright Copyright © 2002-2024 Wiley-VCH Verlag GmbH & Co. KGaA. All Rights Reserved.
Formula C25H37IO9
InChI InChI=1S/C25H37IO9/c1-14(2)7-19(27)34-18-9-17-16(11-32-21(29)10-24(5,6)30)12-33-23(22(17)25(18,31)13-26)35-20(28)8-15(3)4/h9,12,14-15,18,22-23,30-31H,7-8,10-11,13H2,1-6H3
InChIKey HBZBTGAKGOIOAD-UHFFFAOYSA-N
Instrument Name Bruker HX-90
Literature Reference E. Finner, S. David, W. Thies, Planta Medica 50, 4 (1984).
NMR Standard TMS
Origin Chemical Concepts. A Wiley Division. Weinheim, Germany
Solvent CDCl3