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3-Oxo-lansiolic-acid, methylester

View entire compound with spectra: 2 NMR

3-Oxo-lansiolic-acid, methylester
SpectraBase Compound ID 53Cy2vmSIF9
InChI InChI=1S/C31H48O3/c1-20(2)23-12-10-21(3)24(30(23,7)19-17-28(33)34-9)13-14-25-22(4)11-15-26-29(5,6)27(32)16-18-31(25,26)8/h10,23-26H,1,4,11-19H2,2-3,5-9H3
InChIKey IIHDUPROZNJRRB-UHFFFAOYSA-N
Mol Weight 468.7 g/mol
Molecular Formula C31H48O3
Exact Mass 468.360345 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 1XASU3K8rFS
Name 3-OXO-LANSIOLIC-ACID,METHYLESTER
CAS Registry Number 87453-41-6
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C31H48O3
InChI InChI=1S/C31H48O3/c1-20(2)23-12-10-21(3)24(30(23,7)19-17-28(33)34-9)13-14-25-22(4)11-15-26-29(5,6)27(32)16-18-31(25,26)8/h10,23-26H,1,4,11-19H2,2-3,5-9H3
InChIKey IIHDUPROZNJRRB-UHFFFAOYSA-N
Literature Reference Author M.NISHIZAWA,H.NISHIDE,S.KOSELA,Y.HAYASHI
Literature Reference Citation J.ORG.CHEM.,48,4462(1983)
Literature Reference DOI 10.1021/jo00172a004
Molecular Weight 468.720 g/mol
Solvent CDCl3
Source File Reference UNIW11947