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1,3-Hexadiyne

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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: Robert L. Brown and Stephen E. Stein

Reduced pressure boiling point

Tboil (K) Pressure (bar) Reference
332.20.267Weast and Grasselli, 1989
300.20.024Weast and Grasselli, 1989

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 compiled as indicated in comments:
LBLHLM - Sharon G. Lias, John E. Bartmess, Joel F. Liebman, John L. Holmes, Rhoda D. Levin, and W. Gary Mallard
RDSH - Henry M. Rosenstock, Keith Draxl, Bruce W. Steiner, and John T. Herron
LLK - Sharon G. Lias, Rhoda D. Levin, and Sherif A. Kafafi

View reactions leading to C6H6+ (ion structure unspecified)

Ionization energy determinations

IE (eV) Method Reference Comment
9.41PERosenstock, Dannacher, et al., 1982LBLHLM
9.25EIMomigny, Brakier, et al., 1962RDSH

Appearance energy determinations

Ion AE (eV) Other Products MethodReferenceComment
CH3+18.50?EIMomigny, Brakier, et al., 1962RDSH
C3H3+<=11.8C3H3PIDannacher, Stadelmann, et al., 1981LLK
C3H3+12.20?EIMomigny, Brakier, et al., 1962RDSH
C4H2+12.2 ± 0.15C2H4PIDannacher, Stadelmann, et al., 1981LLK
C4H2+14.15?EIMomigny, Brakier, et al., 1962RDSH
C4H3+14.0 ± 0.15C2H3PIDannacher, Stadelmann, et al., 1981LLK
C4H3+15.50?EIMomigny, Brakier, et al., 1962RDSH
C4H4+<=11.8C2H2PIDannacher, Stadelmann, et al., 1981LLK
C4H4+12.C2H2EIMomigny, Brakier, et al., 1962RDSH
C5H2+>17.0CH4PIDannacher, Stadelmann, et al., 1981LLK
C5H3+12.2 ± 0.15CH3PIDannacher, Stadelmann, et al., 1981LLK
C6H3+17.92H2+HEIMomigny, Brakier, et al., 1962RDSH
C6H4+<=11.8H2PIDannacher, Stadelmann, et al., 1981LLK
C6H4+11.07H2EIMomigny, Brakier, et al., 1962RDSH
C6H5+<=11.8HPIDannacher, Stadelmann, et al., 1981LLK
C6H5+11.50HEIMomigny, Brakier, et al., 1962RDSH

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, custom temperature program

View large format table.

Column type Active phase I Reference Comment
CapillaryMethyl Silicone688.Zenkevich, 1998Program: not specified

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.

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]

Rosenstock, Dannacher, et al., 1982
Rosenstock, H.M.; Dannacher, J.; Liebman, J.F., The role of excited electronic states in ion fragmentation: C6H6+, Radiat. Phys. Chem., 1982, 20, 7. [all data]

Momigny, Brakier, et al., 1962
Momigny, J.; Brakier, L.; D'Or, L., Comparaison entre les effets de l'impact electronique sur le benzene et sur les isomeres du benzene en chaine ouverte, Bull. Classe Sci. Acad. Roy. Belg., 1962, 48, 1002. [all data]

Dannacher, Stadelmann, et al., 1981
Dannacher, J.; Stadelmann, J.P.; Vogt, J., On the decay of electronically excited 1,3-hexadiyne cations, Int. J. Mass Spectrom. Ion Processes, 1981, 38, 69. [all data]

Zenkevich, 1998
Zenkevich, I.G., Non-Traditional Criteria for Gas-Chromatographic and Chromato-Mass-Spectrometric Identification of Organic Compounds, Zh. Anal. Khim., 1998, 53, 8, 828-835. [all data]


Notes

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