3-(4-Isopropylphenyl)-2-methylpropionaldehyde

• Formula: C₁₃H₁₈O
• Molecular weight: 190.2814
• IUPAC Standard InChI: InChI=1S/C13H18O/c1-10(2)13-6-4-12(5-7-13)8-11(3)9-14/h4-7,9-11H,8H2,1-3H3 Copy

  
• IUPAC Standard InChIKey: ZFNVDHOSLNRHNN-UHFFFAOYSA-N Copy
• CAS Registry Number: 103-95-7
• Chemical structure:
  This structure is also available as a 2d Mol file or as a computed 3d SD file
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• Other names: α-Methyl-p-isopropylhydrocinnamic aldehyde; 3-(p-Isopropylphenyl)isobutyraldehyde; Benzenepropanal, α-methyl-4-(1-methylethyl)-; Hydrocinnamaldehyde, p-isopropyl-α-methyl-; Aldehyde B; Cyclamal; Cyclamen aldehyde; p-Isopropyl-α-methylhydrocinnamaldehyde; p-Isopropyl-α-methylhydrocinnamic aldehyde; p-Isopropyl-α-methylphenylpropyl aldehyde; α-Methyl-p-isopropylhydrocinnamaldehyde; 2-Methyl-3-(p-isopropylphenyl)propionaldehyde; β-Methyl-p-iso-propyl phenyl propionaldehyde; 2-Methyl-3-(4-isopropylphenyl)-propanal; 3-(p-Isopropylphenyl)-2-methylpropionaldehyde; 3-p-Cumenyl-2-methylpropionaldehyde; Cymal; 3-(4-Isopropylphenyl)-2-methylpropanal
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• Information on this page:
  • Phase change data
  • IR Spectrum
  • Mass spectrum (electron ionization)
  • Gas Chromatography
  • References
  • Notes
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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: William E. Acree, Jr., James S. Chickos

IR 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: NIST Mass Spectrometry Data Center, William E. Wallace, director

Gas Phase Spectrum

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Additional Data

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

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

Kovats' RI, non-polar column, isothermal

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Van Den Dool and Kratz RI, non-polar column, temperature ramp

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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.

Stephenson and Malanowski, 1987
Stephenson, Richard M.; Malanowski, Stanislaw, Handbook of the Thermodynamics of Organic Compounds, 1987, https://doi.org/10.1007/978-94-009-3173-2 . [all data]

Tudor, 1997
Tudor, E., Temperature dependence of the retention index for perfumery compounds on a SE-30 glass capillary column. I. Linear equations, J. Chromatogr. A, 1997, 779, 1-2, 287-297, https://doi.org/10.1016/S0021-9673(97)00453-6 . [all data]

Chang, Sheng, et al., 1989
Chang, L.P.; Sheng, L.S.; Yang, M.Z.; An, D.K., Retention index of essential oil in temperature-programmed capillary column gas chromatography, Acta Pharm. Sin., 1989, 24, 11, 847-852. [all data]

Notes

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• Symbols used in this document:
  

  ΔvapH°

  Enthalpy of vaporization at standard conditions

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