Asarone
- Formula: C12H16O3
- Molecular weight: 208.2536
- IUPAC Standard InChI: InChI=1S/C12H16O3/c1-5-6-9-7-11(14-3)12(15-4)8-10(9)13-2/h5-8H,1-4H3/b6-5+
- IUPAC Standard InChIKey: RKFAZBXYICVSKP-AATRIKPKSA-N
- CAS Registry Number: 2883-98-9
- Chemical structure:
This structure is also available as a 2d Mol file or as a computed 3d SD file
The 3d structure may be viewed using Java or Javascript. - Species with the same structure:
- Stereoisomers:
- Other names: (E)-2,4,5-Trimethoxypropenylbenzene; trans-2,4,5-Trimethoxypropenylbenzene; Benzene, 1,2,4-trimethoxy-5-(1-propenyl)-, (E)-; Benzene, 1,2,4-trimethoxy-5-propenyl-, (E)-; Asaron; Asarone, trans-; α-Asarone; trans-Asarone; Asarum camphor; Benzene, 1,2,4-trimethoxy-5-propenyl-, trans-; Etherophenol; trans-Isoasarone; E-2,4,5-Trimethoxy-prop-1-enylbenzene; (E)-Asarone; trans-Isoasaron; (E)-1,2,4-Trimethoxy-5-(prop-1-en-1-yl)benzene; 1,2,4-Trimethoxy-5-[(1E)-1-propenyl]benzene; (E)-Azarone; (E)-1,2,4-trimethoxy-5-prop-1-enylbenzene
- Information on this page:
- Other data available:
- Options:
Van Den Dool and Kratz RI, non-polar column, temperature ramp
Go To: Top, References, Notes
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
| Column type | Capillary | Capillary | Capillary | Capillary | Capillary |
|---|---|---|---|---|---|
| Active phase | BP-1 | DB-5MS | DB-1 | DB-5 | BP-1 |
| Column length (m) | 50. | 30. | 25. | 30. | 50. |
| Carrier gas | He | H2 | N2 | ||
| Substrate | |||||
| Column diameter (mm) | 0.22 | 0.25 | 0.25 | 0.25 | 0.22 |
| Phase thickness (μm) | 0.25 | 0.25 | 0.25 | 0.25 | 0.25 |
| Tstart (C) | 60. | 40. | 60. | 45. | 60. |
| Tend (C) | 220. | 285. | 180. | 180. | 220. |
| Heat rate (K/min) | 2. | 4.3 | 3. | 2.5 | 2. |
| Initial hold (min) | 10. | 10. | |||
| Final hold (min) | 20. | 10. | 20. | 20. | |
| I | 1646. | 1703. | 1678. | 1693. | 1638. |
| Reference | Boti, Koukoua, et al., 2007 | Radulovic, Misic, et al., 2007 | bin Jantan, Yalvema, et al., 2005 | Zhang, Xu, et al., 2005 | Gonny, Bradesi, et al., 2004 |
| Comment | MSDC-RI | MSDC-RI | MSDC-RI | MSDC-RI | MSDC-RI |
| Column type | Capillary |
|---|---|
| Active phase | HP-5 |
| Column length (m) | |
| Carrier gas | He |
| Substrate | |
| Column diameter (mm) | 0.26 |
| Phase thickness (μm) | 0.25 |
| Tstart (C) | 60. |
| Tend (C) | 240. |
| Heat rate (K/min) | 3. |
| Initial hold (min) | |
| Final hold (min) | |
| I | 1678. |
| Reference | Oprean, Tamas, et al., 1998 |
| Comment | MSDC-RI |
References
Go To: Top, Van Den Dool and Kratz RI, non-polar column, temperature ramp, Notes
Data compilation copyright by the U.S. Secretary of Commerce on behalf of the U.S.A. All rights reserved.
Boti, Koukoua, et al., 2007
Boti, J.B.; Koukoua, G.; N'Guessan, T.Y.; Casanova, J.,
Chemical variability of Conyza sumatrensis and Microglossa pyrifolia from Côte d'Ivoire,
Flavour Fragr. J., 2007, 22, 1, 27-31, https://doi.org/10.1002/ffj.1743
. [all data]
Radulovic, Misic, et al., 2007
Radulovic, N.; Misic, M.; Aleksic, J.; Dokovic, D.; Palic, R.; Stojanovic, G.,
Antimicrobial synergism and antagonism of salicylaldehyde in Filipendula vulgaris essential oil,
Fitoterapia, 2007, 78, 7-8, 565-570, https://doi.org/10.1016/j.fitote.2007.03.022
. [all data]
bin Jantan, Yalvema, et al., 2005
bin Jantan, I.; Yalvema, M.F.; Ahmad, N.W.; Jamal, J.A.,
Insecticidal activities of the leaf oils of eight Cinnamomum species against Aedes aegypti and Aedes albopictus,
Pharm. Biol., 2005, 43, 6, 526-532, https://doi.org/10.1080/13880200500220771
. [all data]
Zhang, Xu, et al., 2005
Zhang, F.; Xu, Q.; Fu, S.; Ma, X.; Xiao, H.; Liang, X.,
Chemical constituents of the essential oil of Asarum forbesii Maxim (Aristolochiaceae),
Flavour Fragr. J., 2005, 20, 3, 318-320, https://doi.org/10.1002/ffj.1423
. [all data]
Gonny, Bradesi, et al., 2004
Gonny, M.; Bradesi, P.; Casanova, J.,
Identification of the components of the essential oil from wild Corsican Daucus carota L. using 13C-NMR spectroscopy,
Flavour Fragr. J., 2004, 19, 5, 424-433, https://doi.org/10.1002/ffj.1330
. [all data]
Oprean, Tamas, et al., 1998
Oprean, R.; Tamas, M.; Sandulescu, R.; Roman, L.,
Essential oils analysis. I. Evaluation of essential oils composition using both GC and MS fingerprints,
J. Pharm. Biomed. Anal., 1998, 18, 4-5, 651-657, https://doi.org/10.1016/S0731-7085(98)00283-0
. [all data]
Notes
Go To: Top, Van Den Dool and Kratz RI, non-polar column, temperature ramp, References
- Symbols used in this document:
Tend Final temperature Tstart Initial temperature - Data from NIST Standard Reference Database 69: NIST Chemistry WebBook
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