Vulgarone A
- Formula: C15H22O
- Molecular weight: 218.3346
- IUPAC Standard InChI: InChI=1S/C15H22O/c1-9-8-10(16)12-13-11(9)15(12,4)7-5-6-14(13,2)3/h8,11-13H,5-7H2,1-4H3/t11-,12+,13?,15?/m0/s1
- IUPAC Standard InChIKey: KTPOZFYJWLGJGH-HJZMNPPUSA-N
- Chemical structure:
This structure is also available as a 2d Mol file - Stereoisomers:
- Other names: α-Longipinen-2-one (Vulgarone B); Vulgarone
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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, non-polar column, temperature ramp
| Column type | Active phase | I | Reference | Comment |
|---|---|---|---|---|
| Capillary | HP-5 | 1647. | Skaltsa, Demetzos, et al., 2003 | 30. m/0.25 mm/0.25 μm, He, 60. C @ 5. min, 4. K/min; Tend: 280. C |
Normal alkane RI, non-polar column, temperature ramp
| Column type | Active phase | I | Reference | Comment |
|---|---|---|---|---|
| Capillary | Ultra 2 | 1596. | Byun and Shin, 2008 | 50. m/0.20 mm/0.11 μm, Helium, 60. C @ 5. min, 2. K/min, 230. C @ 30. min |
Normal alkane RI, non-polar column, custom temperature program
| Column type | Active phase | I | Reference | Comment |
|---|---|---|---|---|
| Capillary | BPX-5 | 1644. | Judzentiene and Mockute, 2005 | 30. m/0.25 mm/0.25 μm; Program: 60C(0.2min) => 3K/min => 186C => 10C/min => 240C (5min) |
| Capillary | CP Sil 5 CB | 1630. | Weyerstahl, Marschall, et al., 1997 | He; Column length: 25. m; Program: not specified |
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.
Skaltsa, Demetzos, et al., 2003
Skaltsa, H.D.; Demetzos, C.; Lazari, D.; Sokovic, M.,
Essential oil analysis and antimicrobial activity of eight Stachys species from Greece,
Phytochemistry, 2003, 64, 3, 743-752, https://doi.org/10.1016/S0031-9422(03)00386-8
. [all data]
Byun and Shin, 2008
Byun, Y.; Shin, S.,
Analysis of compounds and activity of essential oil from Chrysanthemum zawadskii var. latilobum and C. indicum agaunst antibiotic-resistant pathogenic bacteria,
Nat. Prod. Sci., 2008, 14, 2, 138-142. [all data]
Judzentiene and Mockute, 2005
Judzentiene, A.; Mockute, D.,
The inflorescence and leaf essential oils of Tanacetum vulgare L. var. vulgare growing wild in Lithuania,
Biochem. Syst. Ecol., 2005, 33, 5, 487-498, https://doi.org/10.1016/j.bse.2004.11.003
. [all data]
Weyerstahl, Marschall, et al., 1997
Weyerstahl, P.; Marschall, H.; Schröder, M.; Wahlburg, H.-C.; Kaul, V.K.,
The sesquiterpene fraction of the essential oil of Artemisia laciniata Willd.,
Flavour Fragr. J., 1997, 12, 5, 315-325, https://doi.org/10.1002/(SICI)1099-1026(199709/10)12:5<315::AID-FFJ662>3.0.CO;2-Q
. [all data]
Notes
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- Data from NIST Standard Reference Database 69: NIST Chemistry WebBook
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