Phenol, 2-methoxy-4-(1-propenyl)-, acetate
- Formula: C12H14O3
- Molecular weight: 206.2378
- IUPAC Standard InChI: InChI=1S/C12H14O3/c1-4-5-10-6-7-11(15-9(2)13)12(8-10)14-3/h4-8H,1-3H3/b5-4+
- IUPAC Standard InChIKey: IUSBVFZKQJGVEP-SNAWJCMRSA-N
- CAS Registry Number: 93-29-8
- Chemical structure:
This structure is also available as a 2d Mol file - Species with the same structure:
- Stereoisomers:
- Other names: Phenol, 2-methoxy-4-propenyl-, acetate; Acetisoeugenol; Acetylisoeugenol; Isoeugenol, acetate; Isoeugenyl acetate; 2-Methoxy-4-propenylphenyl acetate; Acetoisoeugenol; 4-Acetoxy-3-methoxy-1-propenylbenzene; 2-Methoxy-4-(1-propenyl)phenyl acetate; NSC 46121; O-Acetylisoeugenol; Phenol, 2-methoxy-4-(1-propen-1-yl)-, 1-acetate; 2-methoxy-4-prop-1-enylphenyl acetate
- Information on this page:
- Other data available:
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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, custom temperature program
| Column type | Active phase | I | Reference | Comment |
|---|---|---|---|---|
| Capillary | SE-52 | 1620. | Mondello, Dugo, et al., 1995 | 60. m/0.32 mm/0.40 μm, He; Program: 45 C (6 min) 3 C/min -> 111 0C 2 C/min -> 160 C 3 C/min -> 300 C (15 min) |
Van Den Dool and Kratz RI, polar column, temperature ramp
| Column type | Active phase | I | Reference | Comment |
|---|---|---|---|---|
| Capillary | Carbowax 20M | 2395. | Mondello, Dugo, et al., 1995 | 60. m/0.32 mm/0.425 μm, He, 45. C @ 3. min, 3. K/min, 300. C @ 20. min |
Normal alkane RI, non-polar column, temperature ramp
| Column type | Active phase | I | Reference | Comment |
|---|---|---|---|---|
| Capillary | DB-5 | 1614. | Sylvestre, Pichette, et al., 2007 | 30. m/0.25 mm/0.25 μm, 2. K/min, 250. C @ 33. min; Tstart: 40. C |
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.
Mondello, Dugo, et al., 1995
Mondello, L.; Dugo, P.; Basile, A.; Dugo, G.,
Interactive use of linear retention indices, on polar and apolar columns, with a MS-library for reliable identification of complex mixtures,
J. Microcolumn Sep., 1995, 7, 6, 581-591, https://doi.org/10.1002/mcs.1220070605
. [all data]
Sylvestre, Pichette, et al., 2007
Sylvestre, M.; Pichette, A.; Longtin, A.; Martin, M.-A.C.; Bercion, S.R.; Legault, J.,
Chemical composition of leaf essential oil of Hedyosmum arborescens and evaluation of its anticancer activity,
Natural Product Communications, 2007, 2, 12, 1269-1272. [all data]
Notes
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- Data from NIST Standard Reference Database 69: NIST Chemistry WebBook
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