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benzenamine, 5-[4-[(4-methylphenyl)sulfonyl]-1-piperazinyl]-2-nitro-N-(2-phenoxyethyl)-
SpectraBase Compound ID IQ6OoFHCZ21
InChI InChI=1S/C25H28N4O5S/c1-20-7-10-23(11-8-20)35(32,33)28-16-14-27(15-17-28)21-9-12-25(29(30)31)24(19-21)26-13-18-34-22-5-3-2-4-6-22/h2-12,19,26H,13-18H2,1H3
InChIKey BCNAGKLUPRYTQR-UHFFFAOYSA-N
Mol Weight 496.58 g/mol
Molecular Formula C25H28N4O5S
Exact Mass 496.178041 g/mol

1H Nuclear Magnetic Resonance (NMR) Spectrum

1H Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID KH4XGFxA7Hp
Name benzenamine, 5-[4-[(4-methylphenyl)sulfonyl]-1-piperazinyl]-2-nitro-N-(2-phenoxyethyl)-
Copyright Copyright © 2022-2024 Chemical Block, Russia, Leninsky Prospect 47 - Database Compilation Copyright © 2022-2024 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 496.178041187 u
Formula C25H28N4O5S
InChI InChI=1S/C25H28N4O5S/c1-20-7-10-23(11-8-20)35(32,33)28-16-14-27(15-17-28)21-9-12-25(29(30)31)24(19-21)26-13-18-34-22-5-3-2-4-6-22/h2-12,19,26H,13-18H2,1H3
InChIKey BCNAGKLUPRYTQR-UHFFFAOYSA-N
Molecular Weight 496.582 g/mol
NMR Offset 18.0059
NMR Spectrometer Frequency 300.135
Observed nucleus 1H
Sample State Soluted
Sample_ID 1H_CB_2017_11046
Solvent DMSO-d6
Source Vendor ID: NMR/10251273; Lab Info: LP; Lab Number: LP-2501341
Temperature 29.85 °C