2-Propenoic acid, 3-phenyl-, methyl ester, (E)-
- Formula: C10H10O2
- Molecular weight: 162.1852
- IUPAC Standard InChIKey: CCRCUPLGCSFEDV-BQYQJAHWSA-N
- CAS Registry Number: 1754-62-7
- 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. - Stereoisomers:
- Other names: Cinnamic acid, methyl ester, (E)-; (E)-Methyl cinnamate; trans-Methyl cinnamate; trans-Methyl 3-phenyl-2-propenoate; Methyl (E)-cinnamate; Methyl trans-cinnamate; trans-Cinnamic acid methyl ester; Methyl (E)-3-phenylprop-2-enoate; Methyl (E)-3-phenylpropenoate; Methyl cinnamate, (E); (E)-3-Phenylacrylic acid methyl ester; Methyl (E)-3-phenyl-2-propenoate; Methyl trans-3-phenyl-2-propenoate; Methyl (2E)-3-phenyl-2-propenoate; 925685-28-5
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Normal alkane RI, polar column, temperature ramp
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 | Capillary |
---|---|---|---|---|---|
Active phase | Supelcowax-10 | ZB-Wax | ZB-Wax | ZB-Wax | DB-Wax |
Column length (m) | 30. | 30. | 30. | 30. | 30. |
Carrier gas | He | Helium | Helium | He | H2 |
Substrate | |||||
Column diameter (mm) | 0.25 | 0.32 | 0.32 | 0.32 | 0.32 |
Phase thickness (μm) | 0.25 | 0.25 | 0.25 | 0.25 | 0.25 |
Tstart (C) | 50. | 40. | 40. | 40. | 40. |
Tend (C) | 220. | 250. | 250. | 250. | 230. |
Heat rate (K/min) | 4. | 5. | 5. | 5. | 5. |
Initial hold (min) | 3. | 2. | 2. | 2. | 2. |
Final hold (min) | 30. | 5. | 5. | 10. | 15. |
I | 2095. | 2024. | 2047. | 2046. | 2047. |
Reference | Wong, Lee, et al., 2005 | N/A | N/A | Wu, Krings, et al., 2005 | Wu, Krings, et al., 2005 |
Comment | MSDC-RI | MSDC-RI | MSDC-RI | MSDC-RI | MSDC-RI |
Column type | Capillary | Capillary | Capillary | Capillary |
---|---|---|---|---|
Active phase | ZB-Wax | Innowax | DB-Wax | DB-Wax |
Column length (m) | 30. | 60. | 60. | 60. |
Carrier gas | He | He | He | H2 |
Substrate | ||||
Column diameter (mm) | 0.32 | 0.25 | 0.25 | 0.32 |
Phase thickness (μm) | 0.25 | 0.25 | 0.25 | |
Tstart (C) | 40. | 60. | 45. | 60. |
Tend (C) | 250. | 220. | 240. | 220. |
Heat rate (K/min) | 5. | 4. | 3. | 3. |
Initial hold (min) | 2. | 10. | ||
Final hold (min) | 10. | 10. | ||
I | 2046. | 2096. | 2074. | 2077. |
Reference | Wu, Krings, et al., 2005 | Suleimenov, Atazharova, et al., 2003 | Christoph, 2001 | Werkhoff, Güntert, et al., 1998 |
Comment | MSDC-RI | MSDC-RI | MSDC-RI | MSDC-RI |
References
Go To: Top, Normal alkane RI, polar column, temperature ramp, Notes
Data compilation copyright by the U.S. Secretary of Commerce on behalf of the U.S.A. All rights reserved.
Wong, Lee, et al., 2005
Wong, K.C.; Lee, B.C.; Lam, N.F.; Ibrahim, P.,
Essential oils of the rhizomes of Alpinia conchigera Griff. and Alpinia latilabris Ridl.,
Flavour Fragr. J., 2005, 20, 4, 431-433, https://doi.org/10.1002/ffj.1458
. [all data]
Wu, Krings, et al., 2005
Wu, S.; Krings, U.; Zorn, H.; Berger, R.G.,
Volatile compounds from the fruiting bodies of beefsteak fungus Fistulina hepatica (Schaeffer: Fr.) Fr.,
Food Chem., 2005, 92, 2, 221-226, https://doi.org/10.1016/j.foodchem.2004.07.013
. [all data]
Suleimenov, Atazharova, et al., 2003
Suleimenov, E.M.; Atazharova, G.A.; Demirchi, B.; Baser, K.H.C.; Adekenov, S.M.,
Essential oil composition of Artemisia Lercheana and A. Sieversiana of Kazakhstan flora
in Recent problems of development of new medicines of natural origin, Proceedings of symposium, St.Petersburg - Pushkin, 2003, 382-385. [all data]
Christoph, 2001
Christoph, F.,
Chemische Zuzammensetzung und antimikrobielle Eigenschaften der ätherischen Öle von Leptospermum scoparium J. R. et G. Forst. und anderer Teebaumöle der Gattungen Kunzea, Leptospermum und Melaleuca unter besonderer Berücksichtigung von Handelsölen, Dissertation, University of Hamburg, Germany, 2001, 196. [all data]
Werkhoff, Güntert, et al., 1998
Werkhoff, P.; Güntert, M.; Krammer, G.; Sommer, H.; Kaulen, J.,
Vacuum headspace method in aroma research: flavor chemistry of yellow passion fruits,
J. Agric. Food Chem., 1998, 46, 3, 1076-1093, https://doi.org/10.1021/jf970655s
. [all data]
Notes
Go To: Top, Normal alkane RI, polar column, temperature ramp, References
- Symbols used in this document:
Tend Final temperature Tstart Initial temperature - Data from NIST Standard Reference Database 69: NIST Chemistry WebBook
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