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CIS-2-BENZYL-1-CYCLOHEXYL-3-(METHOXYCARBONYL)-9-METHYL-1,2,3,4-TETRAHYDRO-9H-PYRIDO-[3.4-B]-INDOLE
SpectraBase Compound ID J3OfwvOdou3
InChI InChI=1S/C27H32N2O2/c1-28-23-16-10-9-15-21(23)22-17-24(27(30)31-2)29(18-19-11-5-3-6-12-19)25(26(22)28)20-13-7-4-8-14-20/h3,5-6,9-12,15-16,20,24-25H,4,7-8,13-14,17-18H2,1-2H3/t24-,25-/m1/s1
InChIKey CLMOHDQBABVPKL-JWQCQUIFSA-N
Mol Weight 416.6 g/mol
Molecular Formula C27H32N2O2
Exact Mass 416.246378 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID FwPSRVZXwhz
Name CIS-2-BENZYL-1-CYCLOHEXYL-3-(METHOXYCARBONYL)-9-METHYL-1,2,3,4-TETRAHYDRO-9H-PYRIDO-[3.4-B]-INDOLE
Compound Number 2D
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C27H32N2O2
InChI InChI=1S/C27H32N2O2/c1-28-23-16-10-9-15-21(23)22-17-24(27(30)31-2)29(18-19-11-5-3-6-12-19)25(26(22)28)20-13-7-4-8-14-20/h3,5-6,9-12,15-16,20,24-25H,4,7-8,13-14,17-18H2,1-2H3/t24-,25-/m1/s1
InChIKey CLMOHDQBABVPKL-JWQCQUIFSA-N
Literature Reference Author P.D.BAILEY,S.P.HOLLINSHEAD
Literature Reference Citation HETEROCYCLES,26,389(1987)
Literature Reference DOI 10.3987/R-1987-02-0389
Molecular Weight 416.563 g/mol
Solvent CDCl3
Source File Reference UWED4927