CH3CD2CH3

Formula: C₃H₆D₂
Molecular weight: 46.1079
IUPAC Standard InChI: InChI=1S/C3H8/c1-3-2/h3H2,1-2H3/i3D2
IUPAC Standard InChIKey: ATUOYWHBWRKTHZ-SMZGMGDZSA-N
CAS Registry Number: 2875-95-8
Chemical structure:
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Gas phase ion energetics data

Data compiled by: Henry M. Rosenstock, Keith Draxl, Bruce W. Steiner, and John T. Herron

Ionization energy determinations

IE (eV)	Method	Reference
11.29	EI	Lifshitz and Shapiro, 1967

Appearance energy determinations

Ion	AE (eV)	Other Products	Method	Reference
C₂H₂D₂⁺	11.78	CH₄	EI	Lifshitz and Shapiro, 1967
C₂H₃D⁺	11.99	CH₃D	EI	Lifshitz and Shapiro, 1967
C₂H₃D₂⁺	12.26	CH₃	EI	Lifshitz and Shapiro, 1967
C₃H₅D₂⁺	11.63	H	EI	Lifshitz and Shapiro, 1967
C₃H₆D⁺	11.58 ± 0.05	D	EI	Williams and Hamill, 1968
C₃H₆D⁺	11.63	D	EI	Lifshitz and Shapiro, 1967

References

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Lifshitz and Shapiro, 1967
Lifshitz, C.; Shapiro, M., Isotope effects on metastable transitions. II. CH₃CD₂CH₃, and CD₃CH₂CD₃, J. Chem. Phys., 1967, 46, 4912. [all data]

Williams and Hamill, 1968
Williams, J.M.; Hamill, W.H., Ionization potentials of molecules and free radicals and appearance potentials by electron impact in the mass spectrometer, J. Chem. Phys., 1968, 49, 4467. [all data]

Notes

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Symbols used in this document:

AE Appearance energy
Data from NIST Standard Reference Database 69: NIST Chemistry WebBook
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