Acetic acid, phenylmethyl ester
- Formula: C9H10O2
- Molecular weight: 150.1745
- IUPAC Standard InChI: InChI=1S/C9H10O2/c1-8(10)11-7-9-5-3-2-4-6-9/h2-6H,7H2,1H3
- IUPAC Standard InChIKey: QUKGYYKBILRGFE-UHFFFAOYSA-N
- CAS Registry Number: 140-11-4
- Chemical structure:
This structure is also available as a 2d Mol file or as a computed 3d SD file
View 3d structure (requires JavaScript / HTML 5) - Other names: Acetic acid, benzyl ester; α-Acetoxytoluene; Benzyl acetate; Benzyl ethanoate; NCI-C06508; Benzylester kyseliny octove; Phenylmethyl acetate; Benzyl ester of acetic acid; (Acetoxymethyl)benzene; Plastolin I; NSC 4550
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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 | Packed | Packed |
|---|---|---|---|---|---|
| Active phase | SE-30 | SE-30 | SE-30 | SE-30 | SE-30 |
| Column length (m) | 40. | 3. | 3.7 | ||
| Carrier gas | Ar | ||||
| Substrate | Gas Chrom Q (80-100 mesh) | Chromosorb W AW DMCS | |||
| Column diameter (mm) | 0.35 | ||||
| Phase thickness (μm) | 0.35 | ||||
| Temperature (C) | 120. | 100. | 200. | 150. | 200. |
| I | 1135. | 1135.1 | 1154. | 1145. | 1154. |
| Reference | Tudor and Moldovan, 1999 | Tudor, 1997 | Tarjan, Nyiredy, et al., 1989 | Tiess, 1984 | Haken, Hartley, et al., 1983 |
| Comment | MSDC-RI | MSDC-RI | MSDC-RI | MSDC-RI | MSDC-RI |
| Column type | Packed | Packed | Packed |
|---|---|---|---|
| Active phase | OV-1 | OV-1 | OV-1 |
| Column length (m) | 2. | 2. | 2. |
| Carrier gas | N2 | N2 | N2 |
| Substrate | Gas Chrom Q | Gas Chrom Q | Gas Chrom Q |
| Column diameter (mm) | |||
| Phase thickness (μm) | |||
| Temperature (C) | 140. | 150. | 160. |
| I | 1163. | 1168. | 1177. |
| Reference | Tomori, Kalasz, et al., 1974 | Tomori, Kalasz, et al., 1974 | Tomori, Kalasz, et al., 1974 |
| Comment | 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.
Tudor and Moldovan, 1999
Tudor, E.; Moldovan, D.,
Temperature Dependence of the Retention Index for Perfumery Compounds on a Se-30 Glass Capillary Column. II. The Hyperbolic Equation,
J. Chromatogr., 1999, 848, 1-2, 215-227, https://doi.org/10.1016/S0021-9673(99)00412-4
. [all data]
Tudor, 1997
Tudor, E.,
Temperature dependence of the retention index for perfumery compounds on a SE-30 glass capillary column. I. Linear equations,
J. Chromatogr. A, 1997, 779, 1-2, 287-297, https://doi.org/10.1016/S0021-9673(97)00453-6
. [all data]
Tarjan, Nyiredy, et al., 1989
Tarjan, G.; Nyiredy, Sz.; Gyor, M.; Lombosi, E.R.; Lombosi, T.S.; Budahegyi, M.V.; Meszaros, S.Y.; Takacs, J.M.,
Review. Thirtieth Anniversary of the Retention Index According to Kovats in Gas-Liquid Chromatography,
J. Chromatogr., 1989, 472, 1-92, https://doi.org/10.1016/S0021-9673(00)94099-8
. [all data]
Tiess, 1984
Tiess, D.,
Gaschromatographische Retentionsindices von 125 leicht- bis mittelflüchtigen organischen Substanzen toxikologisch-analytischer Relevanz auf SE-30,
Wiss. Z. Wilhelm-Pieck-Univ. Rostock Math. Naturwiss. Reihe, 1984, 33, 6-9. [all data]
Haken, Hartley, et al., 1983
Haken, J.K.; Hartley, H.N.T.; Srisukh, D.,
Retention increments of aromatic esters,
Chromatographia, 1983, 17, 11, 589-596, https://doi.org/10.1007/BF02261941
. [all data]
Tomori, Kalasz, et al., 1974
Tomori, E.; Kalasz, H.; Nagy, J.; Knoll, J.,
Gas Chromatographic Studies of Derivatives of Celluline-Like Substances,
J. Chromatogr., 1974, 91, 113-118, https://doi.org/10.1016/S0021-9673(01)97890-2
. [all data]
Notes
Go To: Top, Kovats' RI, non-polar column, isothermal, References
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