5-Methyl-4-mercaptohexan-2-one

• Formula: C₇H₁₄OS
• Molecular weight: 146.250
• IUPAC Standard InChI: InChI=1S/C7H14OS/c1-5(2)7(9)4-6(3)8/h5,7,9H,4H2,1-3H3 Copy

  
• IUPAC Standard InChIKey: UQBDDFZDCXIBHM-UHFFFAOYSA-N Copy
• Chemical structure:
  This structure is also available as a 2d Mol file
• Species with the same structure:
  • 5-methyl-4-mercaptohexan-2-one
  • 5-Methyl-4-mercapto-2-hexanone
• Information on this page:
  • Gas Chromatography
  • References
  • Notes
• Options:
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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.

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.

Liu, Cao, et al., 2009
Liu, F.; Cao, C.; Li, X., Quantitative structure-retention relationship study of mercapto-compounds by the method of dividing the molecular structure into substructure, QSAR Comb. Sci., 2009, 28, 11-12, 1358-1366, https://doi.org/10.1002/qsar.200960043 . [all data]

Notes

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