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1-(2-Fluoranyl-4-nitro-5-piperazin-1-yl-phenyl)azepane

View entire compound with spectra: 2 NMR, and 2 MS (GC)

1-(2-Fluoranyl-4-nitro-5-piperazin-1-yl-phenyl)azepane
SpectraBase Compound ID EOLjZTXLZJZ
InChI InChI=1S/C16H23FN4O2/c17-13-11-16(21(22)23)15(20-9-5-18-6-10-20)12-14(13)19-7-3-1-2-4-8-19/h11-12,18H,1-10H2
InChIKey NMUJONASFBFSLI-UHFFFAOYSA-N
Mol Weight 322.38 g/mol
Molecular Formula C16H23FN4O2
Exact Mass 322.180504 g/mol

1H Nuclear Magnetic Resonance (NMR) Spectrum

1H Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID D0zBN1nmIYZ
Name 1H-azepine, 1-[2-fluoro-4-nitro-5-(1-piperazinyl)phenyl]hexahydro-
Copyright Copyright © 2022-2025 Chemical Block, Russia, Leninsky Prospect 47 - Database Compilation Copyright © 2022-2025 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 322.180504158 u
Formula C16H23FN4O2
InChI InChI=1S/C16H23FN4O2/c17-13-11-16(21(22)23)15(20-9-5-18-6-10-20)12-14(13)19-7-3-1-2-4-8-19/h11-12,18H,1-10H2
InChIKey NMUJONASFBFSLI-UHFFFAOYSA-N
Molecular Weight 322.384 g/mol
NMR Offset 18.0068
NMR Spectrometer Frequency 500.134
Observed nucleus 1H
Sample State Soluted
Sample_ID 1H_CB_2017_16894
Solvent DMSO-d6
Source Vendor ID: NMR/11211162; Lab Info: LIP; Lab Number: LIP-0001653