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N-(1-BENZENESULFONYL-3-ETHYL-2-METHYL-4-OXO-4,5,6,7-TETRAHYDRO-5-INDOLYLACETYL)-4-(PARA-FLUOROBENZOYL)-PIPERIDINE
SpectraBase Compound ID LSqyQe0JwHO
InChI InChI=1S/C31H33FN2O5S/c1-3-26-20(2)34(40(38,39)25-7-5-4-6-8-25)27-14-11-23(31(37)29(26)27)19-28(35)33-17-15-22(16-18-33)30(36)21-9-12-24(32)13-10-21/h4-10,12-13,22-23H,3,11,14-19H2,1-2H3
InChIKey JZCBRKSZCQRKNQ-UHFFFAOYSA-N
Mol Weight 564.7 g/mol
Molecular Formula C31H33FN2O5S
Exact Mass 564.209422 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 8TeAwQOrl1G
Name N-(1-BENZENESULFONYL-3-ETHYL-2-METHYL-4-OXO-4,5,6,7-TETRAHYDRO-5-INDOLYLACETYL)-4-(PARA-FLUOROBENZOYL)-PIPERIDINE
Compound Number 9E
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C31H33FN2O5S
InChI InChI=1S/C31H33FN2O5S/c1-3-26-20(2)34(40(38,39)25-7-5-4-6-8-25)27-14-11-23(31(37)29(26)27)19-28(35)33-17-15-22(16-18-33)30(36)21-9-12-24(32)13-10-21/h4-10,12-13,22-23H,3,11,14-19H2,1-2H3
InChIKey JZCBRKSZCQRKNQ-UHFFFAOYSA-N
Literature Reference Author C.F.MASAGUER,I.CASARIEGO,E.RAVINA
Literature Reference Citation CHEM.PHARM.BULL.,47,621(1999)
Literature Reference DOI 10.1248/cpb.47.621
Molecular Weight 564.672 g/mol
Solvent CDCl3
Source File Reference UWLU7982