α-Damascenone

Formula: C₁₃H₁₈O
Molecular weight: 190.2814
IUPAC Standard InChI: InChI=1S/C13H18O/c1-5-7-11(14)12-10(2)8-6-9-13(12,3)4/h5-9,12H,1-4H3/b7-5+
IUPAC Standard InChIKey: JGBBQKAJVHEQJM-FNORWQNLSA-N
Chemical structure:
This structure is also available as a 2d Mol file
Species with the same structure:
- (E)-α-Damascenone
Stereoisomers:
- (Z)-α-Damascenone
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Gas Chromatography

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

Column type	Active phase	I	Reference	Comment
Capillary	HP-5 MS	1386.	Zellner, Amorim, et al., 2009	30. m/0.25 mm/0.25 μm, Helium; Program: 32 0C (1 min) 50 0C/min -> 115 0C 1.5 0C/min -> 145 0C 12 0C/min -> 240 0C (10 min)

Column type	Active phase	I	Reference	Comment
Capillary	HP-20M	1813.	Zellner, Amorim, et al., 2009	25. m/0.20 mm/0.20 μm, Helium; Program: 30 0C (1 min) 50 0C/min -> 110 0C 1.5 0C/min -> 145 0C 4 0C/min -> 220 0C (10 min)

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Zellner, Amorim, et al., 2009
Zellner, B.D.; Amorim, A.C.L.; de Miranda A.L.P.; Alves, R.J.V.; Barbosa, J.P.; da Costa, G.L.; Rezende, C.M., Screening of the odor-activity and bioactiovity of the essential oils of leaves and flowers of Hyptis Passerina Mart. from the Brazilian Cerrado, J. Braz. Chem. Soc., 2009, 20, 2, 322-332, https://doi.org/10.1590/S0103-50532009000200018 . [all data]

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Data from NIST Standard Reference Database 69: NIST Chemistry WebBook
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