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2-Isovaleroyloxy-5,9-diisovaleroyl-oxymethylen-8,9-dihydroxy-3-oxa-bicyclo(4.3.0)nonene-4
SpectraBase Compound ID 7lpmfp585pD
InChI InChI=1S/C25H40O9/c1-14(2)7-20(27)31-11-17-12-32-24(34-22(29)9-16(5)6)23-18(17)10-19(26)25(23,30)13-33-21(28)8-15(3)4/h12,14-16,18-19,23-24,26,30H,7-11,13H2,1-6H3
InChIKey SNWJEAGXJFVRPD-UHFFFAOYSA-N
Mol Weight 484.6 g/mol
Molecular Formula C25H40O9
Exact Mass 484.267233 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID L5sgIqUGpST
Name 2-Isovaleroyloxy-5,9-diisovaleroyl-oxymethylen-8,9-dihydroxy-3-oxa-bicyclo(4.3.0)nonene-4
CAS Registry Number 18296-54-3
Comments COUPLING CONSTANTS +/-5 HZ ONLY
Copyright Copyright © 2002-2024 Wiley-VCH Verlag GmbH & Co. KGaA. All Rights Reserved.
Formula C25H40O9
InChI InChI=1S/C25H40O9/c1-14(2)7-20(27)31-11-17-12-32-24(34-22(29)9-16(5)6)23-18(17)10-19(26)25(23,30)13-33-21(28)8-15(3)4/h12,14-16,18-19,23-24,26,30H,7-11,13H2,1-6H3
InChIKey SNWJEAGXJFVRPD-UHFFFAOYSA-N
Literature Reference K. Bock, S.R. Jensen, Phytochem. 17, 753 (1978).
NMR Standard not reported
Origin Chemical Concepts. A Wiley Division. Weinheim, Germany
Solvent CDCl3