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benzenemethanamine, N-[5-[4-[(4-chlorophenyl)sulfonyl]-1-piperazinyl]-2-nitrophenyl]-
SpectraBase Compound ID 5Md6I7GNhcV
InChI InChI=1S/C23H23ClN4O4S/c24-19-6-9-21(10-7-19)33(31,32)27-14-12-26(13-15-27)20-8-11-23(28(29)30)22(16-20)25-17-18-4-2-1-3-5-18/h1-11,16,25H,12-15,17H2
InChIKey HUJTWHTUGHXMCK-UHFFFAOYSA-N
Mol Weight 486.97 g/mol
Molecular Formula C23H23ClN4O4S
Exact Mass 486.112854 g/mol

1H Nuclear Magnetic Resonance (NMR) Spectrum

1H Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID GWhQt8C2HFL
Name benzenemethanamine, 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 486.112854107 u
Formula C23H23ClN4O4S
InChI InChI=1S/C23H23ClN4O4S/c24-19-6-9-21(10-7-19)33(31,32)27-14-12-26(13-15-27)20-8-11-23(28(29)30)22(16-20)25-17-18-4-2-1-3-5-18/h1-11,16,25H,12-15,17H2
InChIKey HUJTWHTUGHXMCK-UHFFFAOYSA-N
Molecular Weight 486.974 g/mol
NMR Offset 18.0059
NMR Spectrometer Frequency 300.135
Observed nucleus 1H
Sample State Soluted
Sample_ID 1H_CB_2017_7081
Solvent DMSO-d6
Source Vendor ID: NMR/10220679; Lab Info: LP; Lab Number: LP-2501153
Temperature 29.85 °C