t-Butyl nitrite

• Formula: C₄H₉NO₂
• Molecular weight: 103.1198
• IUPAC Standard InChI: InChI=1S/C4H9NO2/c1-4(2,3)7-5-6/h1-3H3 Copy

  
• IUPAC Standard InChIKey: IOGXOCVLYRDXLW-UHFFFAOYSA-N Copy
• CAS Registry Number: 540-80-7
• Chemical structure:
  This structure is also available as a 2d Mol file
• Other names: (CH3)3CONO; tert-Butyl nitrite; Nitrous acid, 1,1-dimethylethyl ester; Nitrous acid, t-butyl ester; α,α-Dimethylethyl nitrite; tert.-Butyl nitrite
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• Information on this page:
  • Gas phase ion energetics data
  • Mass spectrum (electron ionization)
  • UV/Visible spectrum
  • Gas Chromatography
  • References
  • Notes
• Other data available:
  • Gas phase thermochemistry data
  • Condensed phase thermochemistry data
  • Phase change data
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  • Gas Phase Kinetics Database
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Gas phase ion energetics 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 evaluated by: Edward P. Hunter and Sharon G. Lias

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

UV/Visible spectrum

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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: Victor Talrose, Alexander N. Yermakov, Alexy A. Usov, Antonina A. Goncharova, Axlexander N. Leskin, Natalia A. Messineva, Natalia V. Trusova, Margarita V. Efimkina

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

Normal alkane RI, non-polar column, temperature ramp

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Normal alkane RI, polar column, custom temperature program

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References

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

Hunter and Lias, 1998
Hunter, E.P.; Lias, S.G., Evaluated Gas Phase Basicities and Proton Affinities of Molecules: An Update, J. Phys. Chem. Ref. Data, 1998, 27, 3, 413-656, https://doi.org/10.1063/1.556018 . [all data]

Aldrich, 1966
Aldrich, J.E., UV atlas of organic compounds, 1966, 1, C4/3. [all data]

Zenkevich, 2005
Zenkevich, I.G., Experimentally measured retention indices., 2005. [all data]

Zenkevich and Malamakhov, 1984
Zenkevich, I.G.; Malamakhov, A.S., Group Chromato Mass Spectrometric Identification of Alkylnitrites, Zh. Anal. Khim. (Rus), 1984, 39, 10, 1864-1868. [all data]

Notes

Go To: Top, Gas phase ion energetics data, Mass spectrum (electron ionization), UV/Visible spectrum, Gas Chromatography, References

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