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2-[4-(5-chloro-2-methylphenyl)-1-piperazinyl]-1-(5-fluoro-1H-indol-3-yl)ethanone
SpectraBase Compound ID DWgMTXLJBUB
InChI InChI=1S/C21H21ClFN3O/c1-14-2-3-15(22)10-20(14)26-8-6-25(7-9-26)13-21(27)18-12-24-19-5-4-16(23)11-17(18)19/h2-5,10-12,24H,6-9,13H2,1H3
InChIKey HITUPGPATWLBFM-UHFFFAOYSA-N
Mol Weight 385.87 g/mol
Molecular Formula C21H21ClFN3O
Exact Mass 385.135718 g/mol

1H Nuclear Magnetic Resonance (NMR) Spectrum

1H Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID 6mQLM5b0PaZ
Name 2-[4-(5-chloro-2-methylphenyl)-1-piperazinyl]-1-(5-fluoro-1H-indol-3-yl)ethanone
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/C21H21ClFN3O/c1-14-2-3-15(22)10-20(14)26-8-6-25(7-9-26)13-21(27)18-12-24-19-5-4-16(23)11-17(18)19/h2-5,10-12,24H,6-9,13H2,1H3
InChIKey HITUPGPATWLBFM-UHFFFAOYSA-N
NMR Offset 15.5012
NMR Spectrometer Frequency 300.135
Observed nucleus 1H
Origin 1H_SBI_36227_18178
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: D31992; Labnumber: SIMAK-01459; SBI_ID: SBI-018181
Temperature 315 °C