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ethyl 5-ethoxy-3-({[4-(4-fluorophenyl)-1-piperazinyl]acetyl}amino)-1H-indole-2-carboxylate
SpectraBase Compound ID 6yAcJXvyyq
InChI InChI=1S/C25H29FN4O4/c1-3-33-19-9-10-21-20(15-19)23(24(27-21)25(32)34-4-2)28-22(31)16-29-11-13-30(14-12-29)18-7-5-17(26)6-8-18/h5-10,15,27H,3-4,11-14,16H2,1-2H3,(H,28,31)
InChIKey KJOBMBIZNXSXSB-UHFFFAOYSA-N
Mol Weight 468.53 g/mol
Molecular Formula C25H29FN4O4
Exact Mass 468.217284 g/mol

1H Nuclear Magnetic Resonance (NMR) Spectrum

1H Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID BOgxoqaqKEA
Name ethyl 5-ethoxy-3-({[4-(4-fluorophenyl)-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/C25H29FN4O4/c1-3-33-19-9-10-21-20(15-19)23(24(27-21)25(32)34-4-2)28-22(31)16-29-11-13-30(14-12-29)18-7-5-17(26)6-8-18/h5-10,15,27H,3-4,11-14,16H2,1-2H3,(H,28,31)
InChIKey KJOBMBIZNXSXSB-UHFFFAOYSA-N
NMR Offset 15.328
NMR Spectrometer Frequency 300.135
Observed nucleus 1H
Origin 1H_SBI_36227_12566
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: D76910; Labnumber: SIMAK-01823; SBI_ID: SBI-012569
Temperature 318 °C