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2-[2-(1H-indol-3-yl)ethylcarbamoyl]cyclohexane-1-carboxylic acid

View entire compound with spectra: 1 NMR

2-[2-(1H-indol-3-yl)ethylcarbamoyl]cyclohexane-1-carboxylic acid
SpectraBase Compound ID 9SOfdKDxggJ
InChI InChI=1S/C18H22N2O3/c21-17(14-6-1-2-7-15(14)18(22)23)19-10-9-12-11-20-16-8-4-3-5-13(12)16/h3-5,8,11,14-15,20H,1-2,6-7,9-10H2,(H,19,21)(H,22,23)
InChIKey URCMCAGJCXKTIR-UHFFFAOYSA-N
Mol Weight 314.39 g/mol
Molecular Formula C18H22N2O3
Exact Mass 314.163043 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 4pwqAbmdIIo
Name 2-[2-(1H-indol-3-yl)ethylcarbamoyl]cyclohexane-1-carboxylic acid
Compound Number 23
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C18H22N2O3
InChI InChI=1S/C18H22N2O3/c21-17(14-6-1-2-7-15(14)18(22)23)19-10-9-12-11-20-16-8-4-3-5-13(12)16/h3-5,8,11,14-15,20H,1-2,6-7,9-10H2,(H,19,21)(H,22,23)
InChIKey URCMCAGJCXKTIR-UHFFFAOYSA-N
Literature Reference Author F.SORIANO-AGATON,D.LAGOUTTE,E.POUPON,F.ROBLOT,A.FOURNET,J.C. GANTIER,R.HOCQUEMILL
Literature Reference Citation J.NAT.PROD.,68,1581(2005)
Literature Reference DOI 10.1021/np050250z
Molecular Weight 314.384 g/mol
Solvent CDCl3
Source File Reference UWMZ13048