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N-{5-[4-(2,2-dimethylpropanoyl)-1-piperazinyl]-2-nitrophenyl}-N-(3-pyridinylmethyl)amine
SpectraBase Compound ID 8FLk2AEOpvo
InChI InChI=1S/C21H27N5O3/c1-21(2,3)20(27)25-11-9-24(10-12-25)17-6-7-19(26(28)29)18(13-17)23-15-16-5-4-8-22-14-16/h4-8,13-14,23H,9-12,15H2,1-3H3
InChIKey FBUXEQPKBPTJBY-UHFFFAOYSA-N
Mol Weight 397.48 g/mol
Molecular Formula C21H27N5O3
Exact Mass 397.21139 g/mol

1H Nuclear Magnetic Resonance (NMR) Spectrum

1H Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID CEKwdAnCILU
Name N-{5-[4-(2,2-dimethylpropanoyl)-1-piperazinyl]-2-nitrophenyl}-N-(3-pyridinylmethyl)amine
Author A.V.Yarkov, IPAC, Russia
Copyright Copyright © 2016-2024 Chemical Block, Russia, Leninsky Prospect 47 - Database Compilation Copyright © 2016-2021 John Wiley & Sons, Inc. All Rights Reserved.
InChI InChI=1S/C21H27N5O3/c1-21(2,3)20(27)25-11-9-24(10-12-25)17-6-7-19(26(28)29)18(13-17)23-15-16-5-4-8-22-14-16/h4-8,13-14,23H,9-12,15H2,1-3H3
InChIKey FBUXEQPKBPTJBY-UHFFFAOYSA-N
NMR Offset 15.328
NMR Spectrometer Frequency 300.135
Observed nucleus 1H
Origin 1H_SBI_36227_5515
Owner Copyright (C) 2016 Chemical Block, Russia, Leninsky Prospect 47 - Database Compilation Copyright (C) 2016 John Wiley & Sons, Inc.
Sample State soluted
Solvent DMSO-d6
Source File Reference VendorID: D22905; Labnumber: SPKUZ-2190; SBI_ID: SBI-005517
Synonyms 5-[4-(2,2-dimethylpropanoyl)-1-piperazinyl]-2-nitro-N-(3-pyridinylmethyl)aniline
Temperature 318 °C