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1H-pyrazole-1-butanoic acid, 4,5-dihydro-3-(4-nitrophenyl)-gamma-oxo-5-(6-quinoxalinyl)-

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1H-pyrazole-1-butanoic acid, 4,5-dihydro-3-(4-nitrophenyl)-gamma-oxo-5-(6-quinoxalinyl)-
SpectraBase Compound ID 2d6AjOaOhTd
InChI InChI=1S/C21H17N5O5/c27-20(7-8-21(28)29)25-19(14-3-6-16-18(11-14)23-10-9-22-16)12-17(24-25)13-1-4-15(5-2-13)26(30)31/h1-6,9-11,19H,7-8,12H2,(H,28,29)
InChIKey WVENCDZPZSCURX-UHFFFAOYSA-N
Mol Weight 419.4 g/mol
Molecular Formula C21H17N5O5
Exact Mass 419.122969 g/mol

1H Nuclear Magnetic Resonance (NMR) Spectrum

1H Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID B2OQbSoKX8t
Name 1H-pyrazole-1-butanoic acid, 4,5-dihydro-3-(4-nitrophenyl)-gamma-oxo-5-(6-quinoxalinyl)-
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/C21H17N5O5/c27-20(7-8-21(28)29)25-19(14-3-6-16-18(11-14)23-10-9-22-16)12-17(24-25)13-1-4-15(5-2-13)26(30)31/h1-6,9-11,19H,7-8,12H2,(H,28,29)
InChIKey WVENCDZPZSCURX-UHFFFAOYSA-N
NMR Offset 15.5012
NMR Spectrometer Frequency 300.135
Observed nucleus 1H
Origin 1H_SBI_11628_9084
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: F34079; Labnumber: Vost-S0914-0236