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De-15-methyl-14-acetoxy-15-(tetrahydro-4-acetoxy -furan-2-on-4-yl)-18-isopimaranoic acid, methyl ester
SpectraBase Compound ID JAWlKMISSdt
InChI InChI=1S/C28H42O8/c1-17(29)35-23-19-8-9-21-26(4,11-7-12-27(21,5)24(32)33-6)20(19)10-13-25(23,3)15-28(36-18(2)30)14-22(31)34-16-28/h19-21,23H,7-16H2,1-6H3
InChIKey OCDBBRJJZHGFOV-UHFFFAOYSA-N
Mol Weight 506.6 g/mol
Molecular Formula C28H42O8
Exact Mass 506.287968 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID BREjImIUcEK
Name De-15-methyl-14-acetoxy-15-(tetrahydro-4-acetoxy -furan-2-on-4-yl)-18-isopimaranoic acid, methyl ester
CAS Registry Number 127613-28-9
Copyright Copyright © 2002-2025 Wiley-VCH GmbH. All Rights Reserved.
Formula C28H42O8
InChI InChI=1S/C28H42O8/c1-17(29)35-23-19-8-9-21-26(4,11-7-12-27(21,5)24(32)33-6)20(19)10-13-25(23,3)15-28(36-18(2)30)14-22(31)34-16-28/h19-21,23H,7-16H2,1-6H3
InChIKey OCDBBRJJZHGFOV-UHFFFAOYSA-N
Instrument Name Bruker WP-200
Literature Reference A. San Feliciano, M. Medarde, F. Tome, Magn. Res. Chem. 27, 1166 (1989).
NMR Standard TMS
Origin Chemical Concepts. A Wiley Division. Weinheim, Germany
Solvent CDCl3