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1-(2-fluorobenzoyl)-4-(1H-indol-3-ylmethyl)piperazin-4-ium

View entire compound with spectra: 1 NMR

1-(2-fluorobenzoyl)-4-(1H-indol-3-ylmethyl)piperazin-4-ium
SpectraBase Compound ID HzFzvLuwxSt
InChI InChI=1S/C20H20FN3O/c21-18-7-3-1-6-17(18)20(25)24-11-9-23(10-12-24)14-15-13-22-19-8-4-2-5-16(15)19/h1-8,13,22H,9-12,14H2/p+1
InChIKey KXYXFKIVQJTBTN-UHFFFAOYSA-O
Mol Weight 338.41 g/mol
Molecular Formula C20H21FN3O
Exact Mass 338.166865 g/mol

1H Nuclear Magnetic Resonance (NMR) Spectrum

1H Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID KBDBVHiZ8C1
Name 1-(2-fluorobenzoyl)-4-(1H-indol-3-ylmethyl)piperazin-4-ium
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/C20H20FN3O/c21-18-7-3-1-6-17(18)20(25)24-11-9-23(10-12-24)14-15-13-22-19-8-4-2-5-16(15)19/h1-8,13,22H,9-12,14H2/p+1
InChIKey KXYXFKIVQJTBTN-UHFFFAOYSA-O
NMR Offset 15.449
NMR Spectrometer Frequency 300.135
Observed nucleus 1H
Origin 1H_UBI_21270_13603
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: UZI/9310797; UBI_ID: UBI-013606
Temperature 308 °C