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METHYL-3-BENZYL-1-ALPHA-(METHOXYCARBONYL)-7-METHYL-1,2,3,6-TETRAHYDRO-2,6-METHANOAZOCINO-[5,4-B]-INDOLE-5(E)-ACRYLATE
SpectraBase Compound ID C2WDiHhyBp2
InChI InChI=1S/C28H28N2O4/c1-29-22-12-8-7-11-20(22)25-26(28(32)34-3)23-15-21(27(25)29)19(13-14-24(31)33-2)17-30(23)16-18-9-5-4-6-10-18/h4-14,17,21,23,26H,15-16H2,1-3H3/b14-13+/t21-,23-,26-/m1/s1
InChIKey UQEUECCKJZFPNC-ZDHSNQIKSA-N
Mol Weight 456.54 g/mol
Molecular Formula C28H28N2O4
Exact Mass 456.204907 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID CZN5i7jxnJY
Name METHYL-3-BENZYL-1-ALPHA-(METHOXYCARBONYL)-7-METHYL-1,2,3,6-TETRAHYDRO-2,6-METHANOAZOCINO-[5,4-B]-INDOLE-5(E)-ACRYLATE
Compound Number 34B
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C28H28N2O4
InChI InChI=1S/C28H28N2O4/c1-29-22-12-8-7-11-20(22)25-26(28(32)34-3)23-15-21(27(25)29)19(13-14-24(31)33-2)17-30(23)16-18-9-5-4-6-10-18/h4-14,17,21,23,26H,15-16H2,1-3H3/b14-13+/t21-,23-,26-/m1/s1
InChIKey UQEUECCKJZFPNC-ZDHSNQIKSA-N
Literature Reference Author M.L.BENNASAR,E.ZULAICA,A.RAMIREZ,J.BOSCH
Literature Reference Citation J.ORG.CHEM.,61,1239(1996)
Literature Reference DOI 10.1021/jo951456f
Molecular Weight 456.541 g/mol
Solvent CDCl3
Source File Reference UWGE1539