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Methyl [(1-ethyl-1,2,3,4,6,7,8,13b-octahydro-13H-pyrido[1',2' : 1,2]azepino[3,4-b]indole-1-propionate}
SpectraBase Compound ID DcYywbMwQjT
InChI InChI=1S/C22H28N2O3/c1-3-22(13-11-19(26)27-2)12-10-18(25)24-14-6-8-16-15-7-4-5-9-17(15)23-20(16)21(22)24/h4-5,7,9,21,23H,3,6,8,10-14H2,1-2H3/t21-,22-/m0/s1
InChIKey CQBAAHSPRRYFFI-VXKWHMMOSA-N
Mol Weight 368.48 g/mol
Molecular Formula C22H28N2O3
Exact Mass 368.209993 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID GD2c8HXQZAJ
Name METHYL-(1-ETHYL-1,2,3,4,6,7,8,13B-OCTAHYDRO-(13H)-PYRIDO-[1',2':1,2]-AZEPINO-[3,4-B]-INDOLE-1-PROPIONATE)
Compound Number 16B
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C22H28N2O3
InChI InChI=1S/C22H28N2O3/c1-3-22(13-11-19(26)27-2)12-10-18(25)24-14-6-8-16-15-7-4-5-9-17(15)23-20(16)21(22)24/h4-5,7,9,21,23H,3,6,8,10-14H2,1-2H3/t21-,22-/m0/s1
InChIKey CQBAAHSPRRYFFI-VXKWHMMOSA-N
Literature Reference Author A.DANCSO,M.KAJTAR-PEREDY,C.SZANTAY
Literature Reference Citation J.HETCYCL.CHEM.,34,1267(1997)
Literature Reference DOI 10.1002/jhet.5570340430
Molecular Weight 368.476 g/mol
Solvent CDCl3
Source File Reference UWSW701