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(1S,6AS,9AS)-ALPHA-METHOXY-OCTAHYDRO-2-OXO-2-H-CYCLOPENTA-[H]-PYRROLIZIN-1-YL-BENZENE-ACETIC-ACIDESTER
SpectraBase Compound ID KIhJaxlXrNR
InChI InChI=1S/C19H23NO4/c1-23-15(13-7-3-2-4-8-13)18(22)24-16-14-9-5-10-19(14)11-6-12-20(19)17(16)21/h2-4,7-8,14-16H,5-6,9-12H2,1H3/t14-,15+,16+,19+/m1/s1
InChIKey CNBQHNGBCGCOSH-DRMAHVMPSA-N
Mol Weight 329.4 g/mol
Molecular Formula C19H23NO4
Exact Mass 329.162708 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 62fb2hmHgL6
Name (1S,6AS,9AS)-ALPHA-METHOXY-OCTAHYDRO-2-OXO-2-H-CYCLOPENTA-[H]-PYRROLIZIN-1-YL-BENZENE-ACETIC-ACIDESTER
Compound Number 35A
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C19H23NO4
InChI InChI=1S/C19H23NO4/c1-23-15(13-7-3-2-4-8-13)18(22)24-16-14-9-5-10-19(14)11-6-12-20(19)17(16)21/h2-4,7-8,14-16H,5-6,9-12H2,1H3/t14-,15+,16+,19+/m1/s1
InChIKey CNBQHNGBCGCOSH-DRMAHVMPSA-N
Literature Reference Author S.E.DENMARK,D.S.MIDDLETON
Literature Reference Citation J.ORG.CHEM.,63,1604(1998)
Literature Reference DOI 10.1021/jo9719057
Molecular Weight 329.396 g/mol
Sample ID 27969
Solvent CDCl3