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3-Nitro-1,2,4-triazole

Compound with spectra: 6 NMR, 7 FTIR, 3 Raman, 2 UV-Vis, and 4 MS (GC)

3-Nitro-1,2,4-triazole
SpectraBase Compound ID 55a5HsQUe2R
InChI InChI=1S/C2H2N4O2/c7-6(8)2-3-1-4-5-2/h1H,(H,3,4,5)
InChIKey KUEFXPHXHHANKS-UHFFFAOYSA-N
Mol Weight 114.06 g/mol
Molecular Formula C2H2N4O2
Exact Mass 114.017775 g/mol

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FTIR Spectrum
Copyright Copyright © 2012-2025 John Wiley & Sons, Inc. All Rights Reserved.
Source of Sample Sigma-Aldrich Company LLC
Source of Spectrum Forensic Spectral Research
Catalog Number 241792
Technique KBr0

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FTIR Spectrum
Copyright Copyright © 1980, 1981-2025 John Wiley & Sons, Inc. All Rights Reserved.
Source of Sample Fluka Chemie AG, Buchs, Switzerland
Catalog Number 74085
Technique KBr WAFER

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FTIR Spectrum
Copyright Copyright © 2016-2025 John Wiley & Sons, Inc. All Rights Reserved.
Source of Sample Alfa Aesar, Thermo Fisher Scientific
Source of Spectrum Bio-Rad Laboratories, Inc.
Catalog Number L06845
Technique KBr1

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FTIR Spectrum
Copyright Copyright © 2018-2025 Sigma-Aldrich Co. LLC. - Database Compilation Copyright © 2018-2025 John Wiley & Sons, Inc. All Rights Reserved.
Source of Sample Aldrich
Source of Spectrum Sigma-Aldrich Co. LLC.
Catalog Number 241792
Technique Mull

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ATR-IR Spectrum
Copyright Copyright © 2019-2025 John Wiley & Sons, Inc. All Rights Reserved.
Source of Sample Sigma-Aldrich Company LLC
Source of Spectrum Forensic Spectral Research
Catalog Number 241792

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ATR-IR Spectrum
Copyright Copyright © 2016-2025 John Wiley & Sons, Inc. All Rights Reserved.
Source of Sample Alfa Aesar, Thermo Fisher Scientific
Source of Spectrum Bio-Rad Laboratories, Inc.
Catalog Number L06845

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ATR-IR Spectrum
Copyright Copyright © 2018-2025 Sigma-Aldrich Co. LLC. - Database Compilation Copyright © 2018-2025 John Wiley & Sons, Inc. All Rights Reserved.
Source of Sample Aldrich
Catalog Number 241792

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13C NMR Spectrum
Copyright Copyright © 1980, 1981-2025 John Wiley & Sons, Inc. All Rights Reserved.
Source of Sample Fluka AG, Buchs, Switzerland
Solvent Polysol; Reference=TMS Spectrometer= Varian CFT-20

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13C NMR Spectrum
Copyright Copyright © 2016-2025 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Solvent DMSO-D6

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1H NMR Spectrum
Copyright Copyright © 2009-2025 John Wiley & Sons, Inc. All Rights Reserved.
Solvent Polysol

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1H NMR Spectrum
Copyright Copyright © 2016-2025 Chemical Block, Russia, Leninsky Prospect 47 - Database Compilation Copyright © 2016-2025 John Wiley & Sons, Inc. All Rights Reserved.
Solvent DMSO-d6

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1H NMR Spectrum
Copyright Copyright © 2016-2025 Chemical Block, Russia, Leninsky Prospect 47 - Database Compilation Copyright © 2016-2025 John Wiley & Sons, Inc. All Rights Reserved.
Solvent DMSO-d6

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15N NMR Spectrum
Copyright Copyright © 2016-2025 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Solvent DMSO-D6

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Raman Spectrum
Copyright Copyright © 2015-2025 John Wiley & Sons, Inc. All Rights Reserved.
Source of Sample Alfa Aesar, Thermo Fisher Scientific
Source of Spectrum Bio-Rad Laboratories, Inc.
Catalog Number L06845

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Raman Spectrum
Copyright Copyright © 2015-2025 John Wiley & Sons, Inc. All Rights Reserved.
Source of Sample Sigma-Aldrich Company LLC
Source of Spectrum Forensic Spectral Research
Catalog Number 241792

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Raman Spectrum
Copyright Copyright © 2017-2025 Sigma-Aldrich Co. LLC. - Database Compilation Copyright © 2017-2025 John Wiley & Sons, Inc. All Rights Reserved.
Catalog Number 241792

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UV-Vis Spectrum
Copyright Copyright © 2008-2025 John Wiley & Sons, Inc. All Rights Reserved.
Solvent Methanol

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UV-Vis Spectrum
Copyright Copyright © 2008-2025 John Wiley & Sons, Inc. All Rights Reserved.
Solvent Methanol

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MS (GC) Spectrum
Copyright Copyright © 2020-2025 John Wiley & Sons, Inc. All Rights Reserved.
Source of Spectrum AD-0-3209-0

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MS (GC) Spectrum
Copyright Copyright © 2020-2025 John Wiley & Sons, Inc. All Rights Reserved.
Source of Spectrum O1-35-1818-3

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MS (GC) Spectrum
Copyright Copyright © 2020-2025 John Wiley & Sons, Inc. All Rights Reserved.
Source of Spectrum AD-0-2532-0

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MS (GC) Spectrum
Copyright Copyright © 2020-2025 John Wiley & Sons, Inc. All Rights Reserved.
Source of Spectrum AD-0-3210-0
  • 3-Nitro-s-triazole
  • 3-nitro-1H-1,2,4-triazole
  • 5-nitro-s-triazole
  • TRIAZOLE, 1H-1,2,4-, 3-NITRO-,
  • 1H-1,2,4-Triazole, 3-nitro-
  • 5-Nitro-1H-1,2,4-triazole
  • 3-Nitro-4H-[1,2,4]triazole
  • s-Triazole, 3-nitro-
  • EINECS 246-468-1
3-AMINO-1H-1,2,4-TRIAZOLE, MONONITRATE
3-amino-s-triazole, nitrate
3-amino-1h-1,2,4-triazole, phosphate, hemihydrate
3-amino-1H-1,2,4-triazole, sulfate, dihydrate
1H-1,2,4-Triazol-3-amine, N-methyl-
3-amino-1H-1,2,4-triazole, lactate(1:1)(salt)
1H-1,2,4-triazol-5-yldiazane
Amitrole 2ME
Guanazole
3-Amino-as-triazine
Title Journal or Book Year
Tautomerism in nitrotriazoles: structure investigation by combined1H,13C and15N NMR spectroscopy Magnetic Resonance in Chemistry 1998
Vendor/Supplier Catalog Number
Sigma-Aldrich Company LLC
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