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(E)-3-[2-(cyanomethyl)-2,6,7,12-tetrahydropyrido[6,1-a]$b-carbolin-3-yl]acrylic acid ethyl ester
SpectraBase Compound ID CKauQV4uKza
InChI InChI=1S/C22H21N3O2/c1-2-27-21(26)8-7-16-14-25-12-10-18-17-5-3-4-6-19(17)24-22(18)20(25)13-15(16)9-11-23/h3-8,13-15,24H,2,9-10,12H2,1H3/b8-7+
InChIKey CAKMOHCFRWIAHP-BQYQJAHWSA-N
Mol Weight 359.43 g/mol
Molecular Formula C22H21N3O2
Exact Mass 359.163377 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 6zqEJJNGxlB
Name Compound-#22
Comments C/H - shift correlation
Copyright Copyright © 2002-2024 Wiley-VCH Verlag GmbH & Co. KGaA. All Rights Reserved.
Formula C22H21N3O2
InChI InChI=1S/C22H21N3O2/c1-2-27-21(26)8-7-16-14-25-12-10-18-17-5-3-4-6-19(17)24-22(18)20(25)13-15(16)9-11-23/h3-8,13-15,24H,2,9-10,12H2,1H3/b8-7+
InChIKey CAKMOHCFRWIAHP-BQYQJAHWSA-N
Instrument Name SF = 300 MHz
Literature Reference J. Org. Chem. 53, 2383 (1988).
NMR Standard not reported
Origin Chemical Concepts. A Wiley Division. Weinheim, Germany
Solvent CDCl3