6-Azathymine

• Formula: C₄H₅N₃O₂
• Molecular weight: 127.1014
• IUPAC Standard InChI: InChI=1S/C4H5N3O2/c1-2-3(8)5-4(9)7-6-2/h1H3,(H2,5,7,8,9) Copy

  
• IUPAC Standard InChIKey: XZWMZFQOHTWGQE-UHFFFAOYSA-N Copy
• CAS Registry Number: 932-53-6
• Chemical structure:
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• Other names: 1,2,4-Triazine-3,5(2H,4H)-dione, 6-methyl-; as-Triazine-3,5(2H,4H)-dione, 6-methyl-; USAF CB-28; 5-Methyl-6-azauracil; 6-Methyl-as-triazine-3,5(2H,4H)-dione; 6-Methyl-1,2,4-triazine-3,5-dione; 3,5-Dihydroxy-6-methyl-1,2,4-triazine; as-Triazine-3,5-diol, 6-methyl-; 6-Methyl-1,2,4-triazine-3,5(2H,4H)-dione; NSC 3426; NSC 38620; 6-methyl-1,2,4-triazine-3,5-diol
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• Information on this page:
  • Phase change data
  • IR Spectrum
  • Mass spectrum (electron ionization)
  • Gas Chromatography
  • References
  • Notes
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Phase change data

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Data compilation copyright by the U.S. Secretary of Commerce on behalf of the U.S.A. All rights reserved.

Data compiled by: William E. Acree, Jr., James S. Chickos

Enthalpy of sublimation

IR Spectrum

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Data compiled by: Coblentz Society, Inc.

• SOLID (0.7 mg / 650 mg KBr DISC); PERKIN-ELMER 21 (GRATING); 2 cm^-1 resolution

Data compiled by: NIST Mass Spectrometry Data Center, William E. Wallace, director

• gas; HP-GC/MS/IRD

Mass spectrum (electron ionization)

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Data compilation copyright by the U.S. Secretary of Commerce on behalf of the U.S.A. All rights reserved.

Data compiled by: NIST Mass Spectrometry Data Center, William E. Wallace, director

Spectrum

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Additional Data

Gas Chromatography

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Data compilation copyright by the U.S. Secretary of Commerce on behalf of the U.S.A. All rights reserved.

Data compiled by: NIST Mass Spectrometry Data Center, William E. Wallace, director

Van Den Dool and Kratz RI, non-polar column, custom temperature program

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References

Go To: Top, Phase change data, IR Spectrum, Mass spectrum (electron ionization), Gas Chromatography, Notes

Data compilation copyright by the U.S. Secretary of Commerce on behalf of the U.S.A. All rights reserved.

Månsson, Fredga, et al., 1974
Månsson, Margret; Fredga, Arne; Ställberg, Gunnel; Thorin, Hans, A Calorimetric Study of peri Strain in 1,8-Dimethylnaphthalene and 1,4,5,8-Tetramethylnaphthalene., Acta Chem. Scand., 1974, 28b, 677-680, https://doi.org/10.3891/acta.chem.scand.28b-0677 . [all data]

Tret'yakov, 2008
Tret'yakov, K.V., Retention Data. NIST Mass Spectrometry Data Center., NIST Mass Spectrometry Data Center, 2008. [all data]

Notes

Go To: Top, Phase change data, IR Spectrum, Mass spectrum (electron ionization), Gas Chromatography, References

• Symbols used in this document:
  

  ΔsubH

  Enthalpy of sublimation

• Data from NIST Standard Reference Database 69: NIST Chemistry WebBook
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