2-Cyclohexen-1-one, 4-hydroxy-3,5,6-trimethyl-4-(3-oxo-1-butenyl)-

• Formula: C₁₃H₁₈O₃
• Molecular weight: 222.2802
• IUPAC Standard InChI: InChI=1S/C13H18O3/c1-8-7-12(15)10(3)11(4)13(8,16)6-5-9(2)14/h5-7,10-11,16H,1-4H3/b6-5+ Copy

  
• IUPAC Standard InChIKey: IDUJXWVBKIRUFN-AATRIKPKSA-N Copy
• CAS Registry Number: 77846-84-5
• Chemical structure:
  This structure is also available as a 2d Mol file
• Other names: 4-hydroxy-3,5,6-trimethyl-4-(3-oxo-1-butenyl)-2-cyclohexene-1-one
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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

Van Den Dool and Kratz RI, 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.

Shimoda, Shigematsu, et al., 1995
Shimoda, M.; Shigematsu, H.; Shiratsuchi, H.; Osajima, Y., Comparison of the odor concentrates by SDE and adsorptive column method from green tea infusion, J. Agric. Food Chem., 1995, 43, 6, 1616-1620, https://doi.org/10.1021/jf00054a037 . [all data]

Notes

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