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ethyl 5-ethoxy-3-[({4-[3-(trifluoromethyl)phenyl]-1-piperazinyl}acetyl)amino]-1H-indole-2-carboxylate
SpectraBase Compound ID 7WK3knZvWx4
InChI InChI=1S/C26H29F3N4O4/c1-3-36-19-8-9-21-20(15-19)23(24(30-21)25(35)37-4-2)31-22(34)16-32-10-12-33(13-11-32)18-7-5-6-17(14-18)26(27,28)29/h5-9,14-15,30H,3-4,10-13,16H2,1-2H3,(H,31,34)
InChIKey BGDFYIBNSIWRMJ-UHFFFAOYSA-N
Mol Weight 518.54 g/mol
Molecular Formula C26H29F3N4O4
Exact Mass 518.21409 g/mol

1H Nuclear Magnetic Resonance (NMR) Spectrum

1H Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID 5D1FnXeIBpu
Name ethyl 5-ethoxy-3-[({4-[3-(trifluoromethyl)phenyl]-1-piperazinyl}acetyl)amino]-1H-indole-2-carboxylate
Author A.V.Yarkov, IPAC, Russia
Copyright Copyright © 2016-2024 Chemical Block, Russia, Leninsky Prospect 47 - Database Compilation Copyright © 2016-2021 John Wiley & Sons, Inc. All Rights Reserved.
InChI InChI=1S/C26H29F3N4O4/c1-3-36-19-8-9-21-20(15-19)23(24(30-21)25(35)37-4-2)31-22(34)16-32-10-12-33(13-11-32)18-7-5-6-17(14-18)26(27,28)29/h5-9,14-15,30H,3-4,10-13,16H2,1-2H3,(H,31,34)
InChIKey BGDFYIBNSIWRMJ-UHFFFAOYSA-N
NMR Offset 15.328
NMR Spectrometer Frequency 300.135
Observed nucleus 1H
Origin 1H_SBI_36227_12569
Owner Copyright (C) 2016 Chemical Block, Russia, Leninsky Prospect 47 - Database Compilation Copyright (C) 2016 John Wiley & Sons, Inc.
Sample State soluted
Solvent DMSO-d6
Source File Reference VendorID: D76914; Labnumber: SIMAK-01827; SBI_ID: SBI-012572
Temperature 318 °C