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2-(4-methyl-1-piperazinyl)-5-nitrobenzoic acid

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2-(4-methyl-1-piperazinyl)-5-nitrobenzoic acid
SpectraBase Compound ID C21y5AcJkUE
InChI InChI=1S/C12H15N3O4/c1-13-4-6-14(7-5-13)11-3-2-9(15(18)19)8-10(11)12(16)17/h2-3,8H,4-7H2,1H3,(H,16,17)
InChIKey IVCIVEKJLFSWOL-UHFFFAOYSA-N
Mol Weight 265.27 g/mol
Molecular Formula C12H15N3O4
Exact Mass 265.106256 g/mol

1H Nuclear Magnetic Resonance (NMR) Spectrum

1H Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID 91SHuqwondE
Name 2-(4-methyl-1-piperazinyl)-5-nitrobenzoic acid
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/C12H15N3O4/c1-13-4-6-14(7-5-13)11-3-2-9(15(18)19)8-10(11)12(16)17/h2-3,8H,4-7H2,1H3,(H,16,17)
InChIKey IVCIVEKJLFSWOL-UHFFFAOYSA-N
NMR Offset 16.8468
NMR Spectrometer Frequency 250.134
Observed nucleus 1H
Origin 1H_ASIOH_7529_3018
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: NMR/9215405; Labnumber: LP-0502117
Temperature 297 °C