1-Octen-3-yl-acetate
- Formula: C10H18O2
- Molecular weight: 170.2487
- IUPAC Standard InChI: InChI=1S/C10H18O2/c1-4-6-7-8-10(5-2)12-9(3)11/h5,10H,2,4,6-8H2,1,3H3
- IUPAC Standard InChIKey: DOJDQRFOTHOBEK-UHFFFAOYSA-N
- CAS Registry Number: 2442-10-6
- Chemical structure:
This structure is also available as a 2d Mol file - Other names: 1-Octen-3-ol, acetate; Amyl vinyl carbinol acetate; Amyl vinyl carbinyl acetate; 1-Pentylallyl acetate; 1-Octenyl-3-acetate; Oct-1-en-3-yl acetate; Octen-3-yl acetate; 1-Oct-3-enylacetate
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Normal alkane RI, polar column, temperature ramp
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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
| Column type | Capillary | Capillary | Capillary | Capillary | Capillary |
|---|---|---|---|---|---|
| Active phase | DB-Wax | BP-20 | DB-Wax | DB-Wax | TC-Wax |
| Column length (m) | 60. | 25. | 60. | 30. | 60. |
| Carrier gas | Helium | N2 | He | N2 | |
| Substrate | |||||
| Column diameter (mm) | 0.25 | 0.25 | 0.25 | 0.25 | 0.25 |
| Phase thickness (μm) | 0.25 | 0.25 | 0.25 | 0.25 | |
| Tstart (C) | 50. | 60. | 40. | 45. | 80. |
| Tend (C) | 220. | 220. | 200. | 220. | 240. |
| Heat rate (K/min) | 3. | 5. | 2. | 3. | 3. |
| Initial hold (min) | 2. | 2. | 5. | ||
| Final hold (min) | 70. | ||||
| I | 1379. | 1380. | 1379. | 1385. | 1373. |
| Reference | Shimizu, Imayoshi, et al., 2009 | Mallavarapu, Kulkarni, et al., 2004 | Umano, Hagi, et al., 2000 | Mölleken, Sinnwell, et al., 1998 | Shuichi, Masazumi, et al., 1996 |
| Comment | MSDC-RI | 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.
Shimizu, Imayoshi, et al., 2009
Shimizu, Y.; Imayoshi, Y.; Kato, M.; Maeda, K.; Iwabuchi, H.; Shimomura, K.,
Volatiles from leaves of field-grown plants and shoot cultures of Gynura bicolor DC,
Flavour Fragr. J., 2009, 24, 5, 251-258, https://doi.org/10.1002/ffj.1938
. [all data]
Mallavarapu, Kulkarni, et al., 2004
Mallavarapu, G.R.; Kulkarni, R.N.; Baskaran, K.; Ramesh, S.,
The essential oil composition of anise hyssop grown in India,
Flavour Fragr. J., 2004, 19, 4, 351-353, https://doi.org/10.1002/ffj.1316
. [all data]
Umano, Hagi, et al., 2000
Umano, K.; Hagi, Y.; Nakahara, K.; Shoji, A.; Shibamoto, T.,
Volatile chemicals identified in extracts from leaves of Japanese mugwort (Artemisia princeps Pamp.),
J. Agric. Food Chem., 2000, 48, 8, 3463-3469, https://doi.org/10.1021/jf0001738
. [all data]
Mölleken, Sinnwell, et al., 1998
Mölleken, U.; Sinnwell, V.; Kubeczka, K.-H.,
Essential oil composition of Smyrnium olusatrum,
Phytochemistry, 1998, 49, 6, 1709-1714, https://doi.org/10.1016/S0031-9422(98)00195-2
. [all data]
Shuichi, Masazumi, et al., 1996
Shuichi, H.; Masazumi, N.; Hiromu, K.; Kiyoshi, F.,
Comparison of volatile compounds berween the crude drugs, Onji-tsutsu and Onji-niki,
Nippon nogei kagaku kaishi, 1996, 70, 2, 151-160. [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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