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ethyl 3-({[4-(2-fluorophenyl)-1-piperazinyl]acetyl}amino)-5-methoxy-1-methyl-1H-indole-2-carboxylate
SpectraBase Compound ID H36mc6a1BaE
InChI InChI=1S/C25H29FN4O4/c1-4-34-25(32)24-23(18-15-17(33-3)9-10-20(18)28(24)2)27-22(31)16-29-11-13-30(14-12-29)21-8-6-5-7-19(21)26/h5-10,15H,4,11-14,16H2,1-3H3,(H,27,31)
InChIKey UPWGWGOEZBIDDY-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 BsMTTX5h1ZY
Name ethyl 3-({[4-(2-fluorophenyl)-1-piperazinyl]acetyl}amino)-5-methoxy-1-methyl-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/c1-4-34-25(32)24-23(18-15-17(33-3)9-10-20(18)28(24)2)27-22(31)16-29-11-13-30(14-12-29)21-8-6-5-7-19(21)26/h5-10,15H,4,11-14,16H2,1-3H3,(H,27,31)
InChIKey UPWGWGOEZBIDDY-UHFFFAOYSA-N
NMR Offset 15.328
NMR Spectrometer Frequency 300.135
Observed nucleus 1H
Origin 1H_SBI_36227_3990
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: E00087; Labnumber: SIMAK-02125; SBI_ID: SBI-003992
Temperature 318 °C