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4H-1,2,4-Triazole-3-acetic acid, 5-(4-pyridinyl)-, ethyl ester

View entire compound with spectra: 1 NMR, and 1 MS (GC)

4H-1,2,4-Triazole-3-acetic acid, 5-(4-pyridinyl)-, ethyl ester
SpectraBase Compound ID Eha1P3E1Ck1
InChI InChI=1S/C11H12N4O2/c1-2-17-10(16)7-9-13-11(15-14-9)8-3-5-12-6-4-8/h3-6H,2,7H2,1H3,(H,13,14,15)
InChIKey RTCNTPZLDKLUQL-UHFFFAOYSA-N
Mol Weight 232.24 g/mol
Molecular Formula C11H12N4O2
Exact Mass 232.096026 g/mol

1H Nuclear Magnetic Resonance (NMR) Spectrum

1H Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID DuPYvVYzIV
Name 1H-1,2,4-triazole-5-acetic acid, 3-(4-pyridinyl)-, ethyl ester
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/C11H12N4O2/c1-2-17-10(16)7-9-13-11(15-14-9)8-3-5-12-6-4-8/h3-6H,2,7H2,1H3,(H,13,14,15)
InChIKey RTCNTPZLDKLUQL-UHFFFAOYSA-N
NMR Offset 18.0068
NMR Spectrometer Frequency 500.134
Observed nucleus 1H
Origin 1H_ASIOH_7529_6451
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/18251514; Labnumber: L17-0000001