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METHYL_5-(3-ACETOXYPROPYL)-1-ALPHA-(METHOXYCARBONYL)-1,2,5,6-TETRAHYDRO-2,6-METHANO-[1.4]-DIAZOCINO-[1.2-A]-INDOLE-3-(E)-ACRYLATE

View entire compound with spectra: 2 NMR

METHYL_5-(3-ACETOXYPROPYL)-1-ALPHA-(METHOXYCARBONYL)-1,2,5,6-TETRAHYDRO-2,6-METHANO-[1.4]-DIAZOCINO-[1.2-A]-INDOLE-3-(E)-ACRYLATE
SpectraBase Compound ID DbcAvmh9e0p
InChI InChI=1S/C25H28N2O6/c1-16(28)33-12-6-11-26-15-18(9-10-23(29)31-2)19-14-21(26)22-13-17-7-4-5-8-20(17)27(22)24(19)25(30)32-3/h4-5,7-10,13,15,19,21,24H,6,11-12,14H2,1-3H3/b10-9+/t19-,21-,24+/m0/s1
InChIKey WRGZQEDRMHOLDD-ZPNOBTOBSA-N
Mol Weight 452.51 g/mol
Molecular Formula C25H28N2O6
Exact Mass 452.194737 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID EliKmmJM01f
Name METHYL_5-(3-ACETOXYPROPYL)-1-ALPHA-(METHOXYCARBONYL)-1,2,5,6-TETRAHYDRO-2,6-METHANO-[1.4]-DIAZOCINO-[1.2-A]-INDOLE-3-(E)-ACRYLATE
Compound Number 33B
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C25H28N2O6
InChI InChI=1S/C25H28N2O6/c1-16(28)33-12-6-11-26-15-18(9-10-23(29)31-2)19-14-21(26)22-13-17-7-4-5-8-20(17)27(22)24(19)25(30)32-3/h4-5,7-10,13,15,19,21,24H,6,11-12,14H2,1-3H3/b10-9+/t19-,21-,24+/m0/s1
InChIKey WRGZQEDRMHOLDD-ZPNOBTOBSA-N
Literature Reference Author M.L.BENNASAR,E.ZULAICA,J.M.JIMENEZ,J.BOSCH
Literature Reference Citation J.ORG.CHEM.,58,7756(1993)
Literature Reference DOI 10.1021/jo00079a021
Molecular Weight 452.507 g/mol
Solvent CDCl3
Source File Reference UWMZ2029