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Isovaltratum valeryloxyhydrine
SpectraBase Compound ID 70ptRUXO2zS
InChI InChI=1S/C27H40O10/c1-15(2)8-22(29)33-12-19-13-34-26(37-24(31)10-17(5)6)25-20(19)11-21(36-18(7)28)27(25,32)14-35-23(30)9-16(3)4/h11,13,15-17,21,25-26,32H,8-10,12,14H2,1-7H3
InChIKey YPWCGDRLINNRAD-UHFFFAOYSA-N
Mol Weight 524.6 g/mol
Molecular Formula C27H40O10
Exact Mass 524.262147 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID JmUn0p4mc5z
Name Isovaltratum valeryloxyhydrine
CAS Registry Number 98302-73-9
Copyright Copyright © 2002-2024 Wiley-VCH Verlag GmbH & Co. KGaA. All Rights Reserved.
Formula C27H40O10
InChI InChI=1S/C27H40O10/c1-15(2)8-22(29)33-12-19-13-34-26(37-24(31)10-17(5)6)25-20(19)11-21(36-18(7)28)27(25,32)14-35-23(30)9-16(3)4/h11,13,15-17,21,25-26,32H,8-10,12,14H2,1-7H3
InChIKey YPWCGDRLINNRAD-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