β-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-WAYWQWQTSA-N
- CAS Registry Number: 5273-86-9
- 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. - Stereoisomers:
- Other names: Benzene, 1,2,4-trimethoxy-5-(1-propenyl)-, (Z)-; cis-Asarone; cis-β-Asarone; (Z)-Asarone; Benzene, 1,2,4-trimethoxy-5-propenyl-, (Z)-; cis-Isoasarone; cis-Isoelemicin; (Z)-5-Propenyl-1,2,4-trimethoxybenzene; (Z)-β-Asarone; (Z)-Isoelemicin; 1,2,4-Trimethoxy-5-[(1Z)-1-propenyl]benzene; (Z)-1,2,4-Trimethoxy-5-(prop-1-en-1-yl)benzene; (Z)-Azarone; 2,4,5-trimethoxypropen-1-ylbenzene
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Normal alkane RI, polar column, custom temperature program
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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
| Column type | Capillary | Capillary |
|---|---|---|
| Active phase | DB-Wax | Carbowax 20M |
| Column length (m) | 60. | |
| Carrier gas | Helium | |
| Substrate | ||
| Column diameter (mm) | 0.25 | |
| Phase thickness (μm) | 0.25 | |
| Program | 40 0C (3 min) 2 0C/min -> 150 0C 4 0C/min -> 220 0C (20 min) | not specified |
| I | 2252. | 2215. |
| Reference | Gyawali and Kim, 2009 | Vinogradov, 2004 |
| Comment | MSDC-RI | MSDC-RI |
References
Go To: Top, Normal alkane RI, polar column, custom temperature program, Notes
Data compilation copyright by the U.S. Secretary of Commerce on behalf of the U.S.A. All rights reserved.
Gyawali and Kim, 2009
Gyawali, R.; Kim, K.-S.,
Volatile organic compounds of medicinal values from Nepalese Acorus calamus L.,
Kathmandu Univ. J. Sci. Eng. Technol., 2009, 5, II, 51-65. [all data]
Vinogradov, 2004
Vinogradov, B.A.,
Production, composition, properties and application of essential oils, 2004, retrieved from http://viness.narod.ru. [all data]
Notes
Go To: Top, Normal alkane RI, polar column, custom temperature program, References
- Data from NIST Standard Reference Database 69: NIST Chemistry WebBook
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