3-Phenyl-1-propanol, acetate
- Formula: C11H14O2
- Molecular weight: 178.2277
- IUPAC Standard InChIKey: JRJGKUTZNBZHNK-UHFFFAOYSA-N
- CAS Registry Number: 122-72-5
- 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: Benzenepropyl acetate; 1-Propanol, 3-phenyl-, acetate; γ-Phenylpropyl acetate; (3-Acetoxypropyl)benzene; Hydrocinnamyl acetate; 3-Acetoxy-1-phenylpropane; 3-Phenylpropyl acetate; Phenylpropyl acetate; 3-Phenyl-1-propyl acetate; 1-Acetoxy-3-phenylpropane; Benzenepropanol, 1-acetate; Benzenepropanol, acetate; NSC 404453; Acetic acid, 3-phenylpropyl ester
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Normal alkane RI, polar column, custom temperature program
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 |
---|---|---|---|---|
Active phase | DB-Wax | Carbowax 20M | HP-Innowax | DB-Wax |
Column length (m) | 30. | 60. | 60. | |
Carrier gas | Hydrogen | He | Helium | |
Substrate | ||||
Column diameter (mm) | 0.25 | 0.25 | 0.32 | |
Phase thickness (μm) | 0.25 | 0.25 | 0.25 | |
Program | 35 0C (9 min) 5 0C/min -> 80 0C 1 0C/min -> 100 0C 16 0C/min -> 210 0C (20 min) | not specified | 60 0C (10 min) 10 K/min -> 220 0C (10 min) 1K/min -> 240 0C | not specified |
I | 1936. | 1926. | 1965. | 1919. |
Reference | Sampaio, Garruti, et al., 2011 | Vinogradov, 2004 | Baser, Demirci, et al., 2001 | Paniandy, Chane-Ming, et al., 2000 |
Comment | MSDC-RI | MSDC-RI | MSDC-RI | MSDC-RI |
References
Go To: Top, Normal alkane RI, polar column, custom temperature program, Notes
Data compilation copyright by the U.S. Secretary of Commerce on behalf of the U.S.A. All rights reserved.
Sampaio, Garruti, et al., 2011
Sampaio, K.S.; Garruti, D.S.; Franco, M.R.B.; Janzantti, N.S.; Da Silva, M.A.AP.,
Aroma volatiles recovered in the water phase of cashew apple (Anacardium occidentale L.) juice during concentration,
J. Sci. Food Agric., 2011, 91, 10, 1801-1809, https://doi.org/10.1002/jsfa.4385
. [all data]
Vinogradov, 2004
Vinogradov, B.A.,
Production, composition, properties and application of essential oils, 2004, retrieved from http://viness.narod.ru. [all data]
Baser, Demirci, et al., 2001
Baser, K.H.C.; Demirci, B.; Tabanca, N.; Özek, T.; Gören, N.,
Composition of the essential oils of Tanacetum armenum (DC.) Schultz Bip., T. balsamita L., T. chiliophyllum (Fisch. Mey.) Schultz Bip. var. chiliophyllum and T. haradjani (Rech. fil.) Grierson and the enantiomeric distribution of camphor and carvone,
Flavour Fragr. J., 2001, 16, 3, 195-200, https://doi.org/10.1002/ffj.977
. [all data]
Paniandy, Chane-Ming, et al., 2000
Paniandy, J.-C.; Chane-Ming, J.; Pierbattesti, J.-C.,
Chemical Composition of the Essential Oil and Headspace Solid-Phase Microextraction of the Guava Fruit (Psidium guajava L.),
J. Essent. Oil Res., 2000, 12, 153-158. [all data]
Notes
Go To: Top, Normal alkane RI, polar column, custom temperature program, References
- Data from NIST Standard Reference Database 69: NIST Chemistry WebBook
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