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2,2,2-trichloro-N-(4H-1,2,4-triazol-4-yl)acetamide

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2,2,2-trichloro-N-(4H-1,2,4-triazol-4-yl)acetamide
SpectraBase Compound ID 91RSuGKQg5E
InChI InChI=1S/C4H3Cl3N4O/c5-4(6,7)3(12)10-11-1-8-9-2-11/h1-2H,(H,10,12)
InChIKey QKATZSLFBKZQDV-UHFFFAOYSA-N
Mol Weight 229.45 g/mol
Molecular Formula C4H3Cl3N4O
Exact Mass 227.937244 g/mol

1H Nuclear Magnetic Resonance (NMR) Spectrum

1H Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID 2UhZV0xQD89
Name 2,2,2-trichloro-N-(4H-1,2,4-triazol-4-yl)acetamide
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/C4H3Cl3N4O/c5-4(6,7)3(12)10-11-1-8-9-2-11/h1-2H,(H,10,12)
InChIKey QKATZSLFBKZQDV-UHFFFAOYSA-N
NMR Offset 15.449
NMR Spectrometer Frequency 300.135
Observed nucleus 1H
Origin 1H_UBI_21270_157
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: /VSVE0061404; UBI_ID: UBI-000158
Temperature 308 °C