Butanoic acid, 2-propenyl ester
- Formula: C7H12O2
- Molecular weight: 128.1690
- IUPAC Standard InChI: InChI=1S/C7H12O2/c1-3-5-7(8)9-6-4-2/h4H,2-3,5-6H2,1H3
- IUPAC Standard InChIKey: RMZIOVJHUJAAEY-UHFFFAOYSA-N
- CAS Registry Number: 2051-78-7
- 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. - Other names: Butyric acid, allyl ester; Allyl butyrate; Allyl n-butyrate; Allyl butanoate; Vinyl carbinyl butyrate; Allylester kyseliny maselne; 2-Propenyl butanoate
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Kovats' RI, non-polar column, isothermal
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 | Packed |
|---|---|---|---|---|---|
| Active phase | SE-30 | SE-30 | SE-30 | SE-30 | SE-30 |
| Column length (m) | 25. | 25. | 25. | 25. | 3.7 |
| Carrier gas | N2 | N2 | N2 | N2 | |
| Substrate | Celite 560 silanized | ||||
| Column diameter (mm) | 0.33 | 0.33 | 0.33 | 0.33 | |
| Phase thickness (μm) | |||||
| Temperature (C) | 100. | 120. | 140. | 160. | 150. |
| I | 884. | 851. | 868. | 894. | 853. |
| Reference | Haken, Madden, et al., 1985 | Haken, Madden, et al., 1985 | Haken, Madden, et al., 1985 | Haken, Madden, et al., 1985 | Allen and Haken, 1970 |
| Comment | MSDC-RI | MSDC-RI | MSDC-RI | MSDC-RI | MSDC-RI |
References
Go To: Top, Kovats' RI, non-polar column, isothermal, Notes
Data compilation copyright by the U.S. Secretary of Commerce on behalf of the U.S.A. All rights reserved.
Haken, Madden, et al., 1985
Haken, J.K.; Madden, B.G.; Korhonen, I.O.O.,
Gas chromatography of homologous esters. XXXI. Butanoyl and monochlorobutanoyl esters of lower saturated branched chain and unsaturated alcohols on SE-30 and OV-351 capillary columns,
J. Chromatogr., 1985, 325, 61-73, https://doi.org/10.1016/S0021-9673(00)96008-4
. [all data]
Allen and Haken, 1970
Allen, I.D.; Haken, J.K.,
Gas chromatography of homologous esters. Part IV. Influence of stationary phase polarity on retention of unsaturated esters,
J. Chromatogr., 1970, 51, 415-422, https://doi.org/10.1016/S0021-9673(01)96890-6
. [all data]
Notes
Go To: Top, Kovats' RI, non-polar column, isothermal, References
- Data from NIST Standard Reference Database 69: NIST Chemistry WebBook
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