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METHYL-(1RS,2SR,6SR)-5-(2-HYDROXYETHYL)-1-(METHOXYCARBONYL)-1,2,5,6-TETRAHYDRO-2,6-METHANO-[1,4]-DIAZOCINO-[1,2-A]-INDOLE-3-(E)-ACRYLATE
SpectraBase Compound ID 2xMPdhkputj
InChI InChI=1S/C22H24N2O5/c1-28-20(26)8-7-15-13-23(9-10-25)18-12-16(15)21(22(27)29-2)24-17-6-4-3-5-14(17)11-19(18)24/h3-8,11,13,16,18,21,25H,9-10,12H2,1-2H3/b8-7+/t16?,18?,21-/m1/s1
InChIKey NFRPPLMYMQHYSD-NUVOOTKGSA-N
Mol Weight 396.44 g/mol
Molecular Formula C22H24N2O5
Exact Mass 396.168522 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 9AQo21hAPW3
Name METHYL-(1RS,2SR,6SR)-5-(2-HYDROXYETHYL)-1-(METHOXYCARBONYL)-1,2,5,6-TETRAHYDRO-2,6-METHANO-[1,4]-DIAZOCINO-[1,2-A]-INDOLE-3-(E)-ACRYLATE
CAS Registry Number 93630-67-2
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C22H24N2O5
InChI InChI=1S/C22H24N2O5/c1-28-20(26)8-7-15-13-23(9-10-25)18-12-16(15)21(22(27)29-2)24-17-6-4-3-5-14(17)11-19(18)24/h3-8,11,13,16,18,21,25H,9-10,12H2,1-2H3/b8-7+/t16?,18?,21-/m1/s1
InChIKey NFRPPLMYMQHYSD-NUVOOTKGSA-N
Literature Reference Author M.L.BENNASAR,M.ALVAREZ,R.LAVILLA,E.ZULAICA,J.BOSCH
Literature Reference Citation J.ORG.CHEM.,55,1156(1990)
Literature Reference DOI 10.1021/jo00291a013
Molecular Weight 396.443 g/mol
Solvent CDCl3
Source File Reference UWED12518