2-Phenethyl-β-phenylpropionate
- Formula: C17H18O2
- Molecular weight: 254.3236
- IUPAC Standard InChI: InChI=1S/C17H18O2/c18-17(12-11-15-7-3-1-4-8-15)19-14-13-16-9-5-2-6-10-16/h1-10H,11-14H2
- IUPAC Standard InChIKey: QQNDZUIFXZRWFO-UHFFFAOYSA-N
- CAS Registry Number: 28049-10-7
- 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: 3-Phenylpropionic acid, 2-phenylethyl ester; .beta.-Phenylethyl dihydrocinnamate; 2-Phenylethyl 3-phenylpropanoate
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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 | HP-5MS | 2049.3 | Andriamaharavo, 2014 | 30. m/0.25 mm/0.25 μm, He; Program: 60C (1 min) => 5 C/min => 210C => 10 C/min => 280C (15 min) |
Normal alkane RI, non-polar column, custom temperature program
| Column type | Active phase | I | Reference | Comment |
|---|---|---|---|---|
| Capillary | DB-1 | 2015. | Vernin, 1993 | Program: not specified |
Normal alkane RI, polar column, custom temperature program
| Column type | Active phase | I | Reference | Comment |
|---|---|---|---|---|
| Capillary | WAX 51 | 2747. | Vernin, 1993 | Program: not specified |
| Capillary | WAX 51 | 2825. | Vernin, 1993 | Program: not specified |
References
Go To: Top, Gas Chromatography, Notes
Data compilation copyright by the U.S. Secretary of Commerce on behalf of the U.S.A. All rights reserved.
Andriamaharavo, 2014
Andriamaharavo, N.R.,
Retention Data. NIST Mass Spectrometry Data Center., NIST Mass Spectrometry Data Center, 2014. [all data]
Vernin, 1993
Vernin, G.,
Mass spectra and Kovats indices of some phenylpropanoic acid esters found in the essential oil of Cistus ladaniferus L.,
J. Essent. Oil Res., 1993, 5, 5, 563-569, https://doi.org/10.1080/10412905.1993.9698280
. [all data]
Notes
Go To: Top, Gas Chromatography, References
- Data from NIST Standard Reference Database 69: NIST Chemistry WebBook
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