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ethanediamide, N~1~-[2-[4-[(4-bromophenyl)methyl]-1-piperazinyl]ethyl]-N~2~-phenyl-
SpectraBase Compound ID Ab7e8LvOXBv
InChI InChI=1S/C21H25BrN4O2/c22-18-8-6-17(7-9-18)16-26-14-12-25(13-15-26)11-10-23-20(27)21(28)24-19-4-2-1-3-5-19/h1-9H,10-16H2,(H,23,27)(H,24,28)
InChIKey JGUXRHQGSXFHPQ-UHFFFAOYSA-N
Mol Weight 445.36 g/mol
Molecular Formula C21H25BrN4O2
Exact Mass 444.116089 g/mol

1H Nuclear Magnetic Resonance (NMR) Spectrum

1H Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID FfnrKDx7qnJ
Name ethanediamide, N~1~-[2-[4-[(4-bromophenyl)methyl]-1-piperazinyl]ethyl]-N~2~-phenyl-
Copyright Copyright © 2022-2024 Chemical Block, Russia, Leninsky Prospect 47 - Database Compilation Copyright © 2022-2024 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 444.116089059 u
Formula C21H25BrN4O2
InChI InChI=1S/C21H25BrN4O2/c22-18-8-6-17(7-9-18)16-26-14-12-25(13-15-26)11-10-23-20(27)21(28)24-19-4-2-1-3-5-19/h1-9H,10-16H2,(H,23,27)(H,24,28)
InChIKey JGUXRHQGSXFHPQ-UHFFFAOYSA-N
Molecular Weight 445.361 g/mol
NMR Offset 17.0068
NMR Spectrometer Frequency 500.134
Observed nucleus 1H
Sample State Soluted
Sample_ID 1H_CB_2017_8919
Solvent DMSO-d6
Source Vendor ID: NMR/9291254; Lab Info: LP; Lab Number: LP-0200176