Benzenepropanal

• Formula: C₉H₁₀O
• Molecular weight: 134.1751
• IUPAC Standard InChI: InChI=1S/C9H10O/c10-8-4-7-9-5-2-1-3-6-9/h1-3,5-6,8H,4,7H2 Copy

  
• IUPAC Standard InChIKey: YGCZTXZTJXYWCO-UHFFFAOYSA-N Copy
• CAS Registry Number: 104-53-0
• Chemical structure:
  This structure is also available as a 2d Mol file or as a computed 3d SD file
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• Species with the same structure:
  • 3-Phenylpropanal
• Other names: Hydrocinnamaldehyde; β-Phenylpropionaldehyde; Benzylacetaldehyde; Dihydrocinnamaldehyde; Hydrocinnamic aldehyde; 3-Phenyl-1-propanal; 3-Phenylpropanal; 3-Phenylpropionaldehyde; 3-Phenylpropylaldehyde; Propionaidehyde, 3-phenyl-; 3-Phenylpropan-1-al; NSC 9271; phenyl propionaldehyde
• Information on this page:
  • Gas phase ion energetics data
  • IR Spectrum
  • References
  • Notes
• Other data available:
  • Phase change data
  • Mass spectrum (electron ionization)
  • UV/Visible spectrum
  • Gas Chromatography
• Options:
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Gas phase ion energetics data

Go To: Top, IR Spectrum, 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: Henry M. Rosenstock, Keith Draxl, Bruce W. Steiner, and John T. Herron

View reactions leading to C₉H₁₀O⁺ (ion structure unspecified)

Appearance energy determinations

IR Spectrum

Go To: Top, 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

Gas Phase Spectrum

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Notice: Concentration information is not available for this spectrum and, therefore, molar absorptivity values cannot be derived.

Additional Data

References

Go To: Top, Gas phase ion energetics data, IR Spectrum, Notes

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

Occolowitz, 1967
Occolowitz, J.L., Charge localization and the electronimpact fragmentation of carbonyl compounds, Australian J. Chem., 1967, 20, 2387. [all data]

Notes

Go To: Top, Gas phase ion energetics data, IR Spectrum, References

• Symbols used in this document:
  

  AE	Appearance energy

• Data from NIST Standard Reference Database 69: NIST Chemistry WebBook
• The National Institute of Standards and Technology (NIST) uses its best efforts to deliver a high quality copy of the Database and to verify that the data contained therein have been selected on the basis of sound scientific judgment. However, NIST makes no warranties to that effect, and NIST shall not be liable for any damage that may result from errors or omissions in the Database.
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