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1 beta-(2-carboxyethyl)-1-ethyl-2,3,4,6,7,12-hexahydro-1H-indolo[2,3-a] quinolizin-5-ium perchlorate, methyl ester
SpectraBase Compound ID 2FyrqOLpvrX
InChI InChI=1S/C21H26N2O2.ClHO4/c1-3-21(12-9-18(24)25-2)11-6-13-23-14-10-16-15-7-4-5-8-17(15)22-19(16)20(21)23;2-1(3,4)5/h4-5,7-8H,3,6,9-14H2,1-2H3;(H,2,3,4,5)/t21-;/m1./s1
InChIKey YXTZFXHNYGORHY-ZMBIFBSDSA-N
Mol Weight 438.91 g/mol
Molecular Formula C21H27ClN2O6
Exact Mass 438.155764 g/mol

Transmission Infrared (IR) Spectrum

Transmission Infrared (IR) Spectrum

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SpectraBase Spectrum ID K3bMqjptp7m
Name 1beta-(2-CARBOXYETHYL)-1-ETHYL-2,3,4,6,7,12-HEXAHYDRO-1H-INDOLO[2,3-a]QUINOLIZIN-5-IUM PERCHLORATE, METHYL ESTER
Source of Sample G. Kalaus, Technical University of Budapest, Budapest, Hungary
Copyright Copyright © 1980, 1981-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C21H27ClN2O6
InChI InChI=1S/C21H26N2O2.ClHO4/c1-3-21(12-9-18(24)25-2)11-6-13-23-14-10-16-15-7-4-5-8-17(15)22-19(16)20(21)23;2-1(3,4)5/h4-5,7-8H,3,6,9-14H2,1-2H3;(H,2,3,4,5)/t21-;/m1./s1
InChIKey YXTZFXHNYGORHY-ZMBIFBSDSA-N
Literature Reference TETRAHEDRON LETT. 1979, 2373 Abstract-Chemical Abstracts= 92, 76343(1980)
Melting Point 188-189C
Molecular Weight 438.904999
Synonyms 1H-INDOLO/2,3-A/QUINOLIZIN-5-IUM PER- CHLORATE, 1B-/2-CARBOXYETHYL/-1-ETHYL- 2,3,4,6,7,12-HEXAHYDRO-, METHYL ESTER
Technique KBr WAFER