Methanone, phenyl-2-pyridinyl-

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Phase change data

Go To: Top, Gas phase ion energetics data, Mass spectrum (electron ionization), References, Notes

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

Data compiled as indicated in comments:
BS - Robert L. Brown and Stephen E. Stein
AC - William E. Acree, Jr., James S. Chickos

Quantity Value Units Method Reference Comment
Tboil590.2KN/AWeast and Grasselli, 1989BS
Tboil590.KN/ABuckingham and Donaghy, 1982BS
Quantity Value Units Method Reference Comment
Tfus315. - 317.KN/ABuckingham and Donaghy, 1982BS

Reduced pressure boiling point

Tboil (K) Pressure (atm) Reference Comment
444.20.013Weast and Grasselli, 1989BS
443. - 445.0.013Buckingham and Donaghy, 1982BS

Enthalpy of fusion

ΔfusH (kcal/mol) Temperature (K) Method Reference Comment
4.998316.5ACWang, Tan, et al., 2006Based on data from 80. - 340. K.; AC

Gas phase ion energetics data

Go To: Top, Phase change data, Mass spectrum (electron ionization), References, Notes

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

Data compiled by: Sharon G. Lias, Rhoda D. Levin, and Sherif A. Kafafi

Ionization energy determinations

IE (eV) Method Reference
9.06EISchubert and Grutzmacher, 1980
9.06EIGrutzmacher, Schaldach, et al., 1980
9.1 ± 0.1EIGrutzmacher and Schubert, 1979

Appearance energy determinations

Ion AE (eV) Other Products MethodReferenceComment
C7H5O+11.7 ± 0.1C5H4NEIGrutzmacher and Schubert, 1979 
C12H8NO+9.97HEISchubert and Grutzmacher, 1980 
C12H8NO+10.0HEIGrutzmacher, Schaldach, et al., 1980 

Mass spectrum (electron ionization)

Go To: Top, Phase change data, Gas phase ion energetics data, References, Notes

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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Mass spectrum
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Additional Data

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Owner NIST Mass Spectrometry Data Center
Collection (C) 2014 copyright by the U.S. Secretary of Commerce
on behalf of the United States of America. All rights reserved.
Origin D.HENNEBERG, MAX-PLANCK INSTITUTE, MULHEIM, WEST GERMANY
NIST MS number 61634

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References

Go To: Top, Phase change data, Gas phase ion energetics data, Mass spectrum (electron ionization), Notes

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

Weast and Grasselli, 1989
CRC Handbook of Data on Organic Compounds, 2nd Editon, Weast,R.C and Grasselli, J.G., ed(s)., CRC Press, Inc., Boca Raton, FL, 1989, 1. [all data]

Buckingham and Donaghy, 1982
Buckingham, J.; Donaghy, S.M., Dictionary of Organic Compounds: Fifth Edition, Chapman and Hall, New York, 1982, 1. [all data]

Wang, Tan, et al., 2006
Wang, M.-H.; Tan, Z.-C.; Shi, Q.; Sun, L.-X.; Zhang, T., Heat capacities and thermodynamic properties of 2-benzoylpyridine (C12H9NO), J Therm Anal Calorim, 2006, 84, 2, 413-418, https://doi.org/10.1007/s10973-005-6971-6 . [all data]

Schubert and Grutzmacher, 1980
Schubert, R.; Grutzmacher, H.-F., Kinetic energy release and position of transition state during the intramolecular substitution of ionized 2-benzoyl pyridines, Org. Mass Spectrom., 1980, 15, 122. [all data]

Grutzmacher, Schaldach, et al., 1980
Grutzmacher, H.-F.; Schaldach, B.; Schubert, R.; Ramana, D.V., Ion kinetic energy release as a transition state probe in intramolecular aromatic substitutions, Adv. Mass Spectrom., 1980, 8, 795. [all data]

Grutzmacher and Schubert, 1979
Grutzmacher, H.-F.; Schubert, R., Substituent effects in the mass spectra of benzoyl hetarenes, Org. Mass Spectrom., 1979, 14, 567. [all data]


Notes

Go To: Top, Phase change data, Gas phase ion energetics data, Mass spectrum (electron ionization), References