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ethyl 5-chloro-3-({[4-(2-pyridinyl)-1-piperazinyl]acetyl}amino)-1H-indole-2-carboxylate
SpectraBase Compound ID C5YGgFMjJIJ
InChI InChI=1S/C22H24ClN5O3/c1-2-31-22(30)21-20(16-13-15(23)6-7-17(16)25-21)26-19(29)14-27-9-11-28(12-10-27)18-5-3-4-8-24-18/h3-8,13,25H,2,9-12,14H2,1H3,(H,26,29)
InChIKey JYQDVLZTHCROAK-UHFFFAOYSA-N
Mol Weight 441.92 g/mol
Molecular Formula C22H24ClN5O3
Exact Mass 441.156767 g/mol

1H Nuclear Magnetic Resonance (NMR) Spectrum

1H Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID JWXTuoIudLG
Name ethyl 5-chloro-3-({[4-(2-pyridinyl)-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/C22H24ClN5O3/c1-2-31-22(30)21-20(16-13-15(23)6-7-17(16)25-21)26-19(29)14-27-9-11-28(12-10-27)18-5-3-4-8-24-18/h3-8,13,25H,2,9-12,14H2,1H3,(H,26,29)
InChIKey JYQDVLZTHCROAK-UHFFFAOYSA-N
NMR Offset 15.328
NMR Spectrometer Frequency 300.135
Observed nucleus 1H
Origin 1H_SBI_36227_11819
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: D64070; Labnumber: SIMAK-01774; SBI_ID: SBI-011822
Temperature 318 °C