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benzenemethanamine, N-[5-[4-[(4-bromophenyl)sulfonyl]-1-piperazinyl]-2-nitrophenyl]-alpha-methyl-
SpectraBase Compound ID 62fWVElHhKr
InChI InChI=1S/C24H25BrN4O4S/c1-18(19-5-3-2-4-6-19)26-23-17-21(9-12-24(23)29(30)31)27-13-15-28(16-14-27)34(32,33)22-10-7-20(25)8-11-22/h2-12,17-18,26H,13-16H2,1H3
InChIKey KNBAWKPIEGKLSS-UHFFFAOYSA-N
Mol Weight 545.45 g/mol
Molecular Formula C24H25BrN4O4S
Exact Mass 544.077989 g/mol

1H Nuclear Magnetic Resonance (NMR) Spectrum

1H Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID CkUoI5inbsk
Name benzenemethanamine, N-[5-[4-[(4-bromophenyl)sulfonyl]-1-piperazinyl]-2-nitrophenyl]-alpha-methyl-
Copyright Copyright © 2022-2024 Chemical Block, Russia, Leninsky Prospect 47 - Database Compilation Copyright © 2022-2024 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 544.077989471 u
Formula C24H25BrN4O4S
InChI InChI=1S/C24H25BrN4O4S/c1-18(19-5-3-2-4-6-19)26-23-17-21(9-12-24(23)29(30)31)27-13-15-28(16-14-27)34(32,33)22-10-7-20(25)8-11-22/h2-12,17-18,26H,13-16H2,1H3
InChIKey KNBAWKPIEGKLSS-UHFFFAOYSA-N
Molecular Weight 545.452 g/mol
NMR Offset 18.0068
NMR Spectrometer Frequency 500.134
Observed nucleus 1H
Sample State Soluted
Sample_ID 1H_CB_2021_85
Solvent DMSO-d6
Source Vendor ID: NMR/12320368; Lab Info: KMA; Lab Number: S16699