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1H-1,2,4-triazole-5-acetic acid, 3-(4-nitrophenyl)-

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1H-1,2,4-triazole-5-acetic acid, 3-(4-nitrophenyl)-
SpectraBase Compound ID AnE3nfXw3bB
InChI InChI=1S/C10H8N4O4/c15-9(16)5-8-11-10(13-12-8)6-1-3-7(4-2-6)14(17)18/h1-4H,5H2,(H,15,16)(H,11,12,13)
InChIKey PUDWBRMRYFQHKH-UHFFFAOYSA-N
Mol Weight 248.2 g/mol
Molecular Formula C10H8N4O4
Exact Mass 248.054555 g/mol

1H Nuclear Magnetic Resonance (NMR) Spectrum

1H Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID HSx4cFXtAge
Name 1H-1,2,4-triazole-5-acetic acid, 3-(4-nitrophenyl)-
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/C10H8N4O4/c15-9(16)5-8-11-10(13-12-8)6-1-3-7(4-2-6)14(17)18/h1-4H,5H2,(H,15,16)(H,11,12,13)
InChIKey PUDWBRMRYFQHKH-UHFFFAOYSA-N
NMR Offset 18.0068
NMR Spectrometer Frequency 500.134
Observed nucleus 1H
Origin 1H_ASIOH_7529_5746
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/18211064; Labnumber: DOR-803488