Lavandulyl isobutyrate
- Formula: C14H24O2
- Molecular weight: 224.3392
- IUPAC Standard InChI: InChI=1S/C14H24O2/c1-10(2)7-8-13(11(3)4)9-16-14(15)12(5)6/h7,12-13H,3,8-9H2,1-2,4-6H3
- IUPAC Standard InChIKey: HPBLXFPAJRUZKY-UHFFFAOYSA-N
- CAS Registry Number: 51117-20-5
- Chemical structure:
This structure is also available as a 2d Mol file - Other names: (R)-5-Methyl-2-(prop-1-en-2-yl)hex-4-en-1-yl isobutyrate; Propanoic acid, 2-methyl-, (2R)-5-methyl-2-(1-methylethenyl)-4-hexen-1-yl ester; Propanoic acid, 2-methyl-, (2R)-5-methyl-2-(1-methylethenyl)-4-hexenyl ester; Propanoic acid, 2-methyl-, 5-methyl-2-(1-methylethenyl)-4-hexenyl ester, (R)-; (+-)-Lavandulol, 2-methylpropionate
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- Other data available:
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Van Den Dool and Kratz 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 |
|---|---|---|
| Active phase | RTX-Wax | BP-20 |
| Column length (m) | 60. | 50. |
| Carrier gas | He | He |
| Substrate | ||
| Column diameter (mm) | 0.22 | 0.22 |
| Phase thickness (μm) | 0.25 | 0.25 |
| Tstart (C) | 60. | 60. |
| Tend (C) | 230. | 230. |
| Heat rate (K/min) | 2. | 2. |
| Initial hold (min) | ||
| Final hold (min) | 35. | 35. |
| I | 1677. | 1674. |
| Reference | Paolini, Costa, et al., 2005 | Vellutini, Baldovini, et al., 2005 |
| Comment | MSDC-RI | MSDC-RI |
References
Go To: Top, Van Den Dool and Kratz 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.
Paolini, Costa, et al., 2005
Paolini, J.; Costa, J.; Bernardini, A.,
Analysis of the essential oil from aerial parts of Eupatorium cannabinum subsp. corsicum (L.) by gas chromatography with electron impact and chemical ionization mass spectrometry,
J. Chromatogr. A, 2005, 1076, 1-2, 170-178, https://doi.org/10.1016/j.chroma.2005.03.131
. [all data]
Vellutini, Baldovini, et al., 2005
Vellutini, M.; Baldovini, N.; de Rocca Serra, D. Tomi; Casanova, J.,
β-Cyclolavandulyl and β-isocyclolavandulyl esters from Peucedanum paniculatum L., an endemic species to Corsica,
Phytochemistry, 2005, 66, 16, 1956-1962, https://doi.org/10.1016/j.phytochem.2005.07.001
. [all data]
Notes
Go To: Top, Van Den Dool and Kratz 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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