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1-(2-fluorobenzoyl)-4-[(1-methyl-1H-pyrrol-2-yl)methyl]piperazin-4-ium
SpectraBase Compound ID HEWN1sW7fhB
InChI InChI=1S/C17H20FN3O/c1-19-8-4-5-14(19)13-20-9-11-21(12-10-20)17(22)15-6-2-3-7-16(15)18/h2-8H,9-13H2,1H3/p+1
InChIKey ANJHZZNDQTVMDD-UHFFFAOYSA-O
Mol Weight 302.37 g/mol
Molecular Formula C17H21FN3O
Exact Mass 302.166865 g/mol

1H Nuclear Magnetic Resonance (NMR) Spectrum

1H Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID KqEOomyfuuy
Name 1-(2-fluorobenzoyl)-4-[(1-methyl-1H-pyrrol-2-yl)methyl]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/C17H20FN3O/c1-19-8-4-5-14(19)13-20-9-11-21(12-10-20)17(22)15-6-2-3-7-16(15)18/h2-8H,9-13H2,1H3/p+1
InChIKey ANJHZZNDQTVMDD-UHFFFAOYSA-O
NMR Offset 15.3537
NMR Spectrometer Frequency 300.135
Observed nucleus 1H
Origin 1H_UBI_21270_13650
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/9311163; UBI_ID: UBI-013653
Temperature 308 °C