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benzenemethanamine, 4-chloro-N-[5-[4-[(4-chlorophenyl)sulfonyl]-1-piperazinyl]-2-nitrophenyl]-
SpectraBase Compound ID J5NuJInbeQC
InChI InChI=1S/C23H22Cl2N4O4S/c24-18-3-1-17(2-4-18)16-26-22-15-20(7-10-23(22)29(30)31)27-11-13-28(14-12-27)34(32,33)21-8-5-19(25)6-9-21/h1-10,15,26H,11-14,16H2
InChIKey UPSGSIMPGQJFIW-UHFFFAOYSA-N
Mol Weight 521.42 g/mol
Molecular Formula C23H22Cl2N4O4S
Exact Mass 520.073882 g/mol

1H Nuclear Magnetic Resonance (NMR) Spectrum

1H Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID LcO6B9HieXF
Name benzenemethanamine, 4-chloro-N-[5-[4-[(4-chlorophenyl)sulfonyl]-1-piperazinyl]-2-nitrophenyl]-
Copyright Copyright © 2022-2024 Chemical Block, Russia, Leninsky Prospect 47 - Database Compilation Copyright © 2022-2024 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 520.073881774 u
Formula C23H22Cl2N4O4S
InChI InChI=1S/C23H22Cl2N4O4S/c24-18-3-1-17(2-4-18)16-26-22-15-20(7-10-23(22)29(30)31)27-11-13-28(14-12-27)34(32,33)21-8-5-19(25)6-9-21/h1-10,15,26H,11-14,16H2
InChIKey UPSGSIMPGQJFIW-UHFFFAOYSA-N
Molecular Weight 521.419 g/mol
NMR Offset 18.0059
NMR Spectrometer Frequency 300.135
Observed nucleus 1H
Sample State Soluted
Sample_ID 1H_CB_2017_11048
Solvent DMSO-d6
Source Vendor ID: NMR/10251276; Lab Info: LP; Lab Number: LP-2501344
Temperature 29.85 °C