1-Naphthalenepropanol, α-ethenyldecahydro-α,5,5,8a-tetramethyl-2-methylene-, [1S-[1α(S*),4aβ,8aα]]-
- Formula: C20H34O
- Molecular weight: 290.4834
- IUPAC Standard InChI: InChI=1S/C20H34O/c1-7-19(5,21)14-11-16-15(2)9-10-17-18(3,4)12-8-13-20(16,17)6/h7,16-17,21H,1-2,8-14H2,3-6H3/t16-,17?,19?,20+/m1/s1
- IUPAC Standard InChIKey: CECREIRZLPLYDM-OQUMVOOASA-N
- CAS Registry Number: 596-85-0
- Chemical structure:
This structure is also available as a 2d Mol file - Stereoisomers:
- Other names: Labda-8(20),14-dien-13-ol, (13R)-; Manool
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- Other data available:
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Normal alkane RI, non-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 | Capillary |
|---|---|---|---|---|---|
| Active phase | TR-5 MS | TR-5 MS | HP-5 | DB-5 | HP-5 |
| Column length (m) | 15. | 15. | 25. | 30. | 30. |
| Carrier gas | Helium | Helium | Hydrogen | Helium | Helium |
| Substrate | |||||
| Column diameter (mm) | 0.25 | 0.25 | 0.32 | 0.32 | 0.25 |
| Phase thickness (μm) | 0.25 | 0.25 | 0.52 | 0.25 | |
| Program | 35 0C (3 min) 2 0C/min -> 60 0C (3 min) 2 0C/min -> 80 0C (3 min) 4 0C/min -> 120 0C (3 min) 5 0C/min -> 150 0C (3 min) 15 0C/min -> 240 0C (10 min) | 35 0C (3 min) 2 0C/min -> 60 0C (3 min) 2 0C/min -> 80 0C (3 min) 4 0C/min -> 120 0C (3 min) 5 0C/min -> 150 0C (3 mion) 15 0C/min -> 240 0C (10 min) | not specified | not specified | 130 0C 5 0C/min -> 240 0C 15 0C/min -> 320 0C (10 min) |
| I | 2047. | 2067. | 2057. | 2056. | 2063. |
| Reference | Kurashov, Mitrukova, et al., 2014 | Kurashov, Krylova, et al., 2013 | Velickovic, Ristic, et al., 2012 | Yusuf and Bewaji, 2011 | Vichi, Aumatell, et al., 2008 |
| Comment | MSDC-RI | MSDC-RI | MSDC-RI | MSDC-RI | MSDC-RI |
| Column type | Capillary | Capillary | Capillary |
|---|---|---|---|
| Active phase | HP-5MS | CP Sil 8 CB | DB-5 |
| Column length (m) | 30. | 50. | 30. |
| Carrier gas | He | He | |
| Substrate | |||
| Column diameter (mm) | 0.25 | 0.32 | 0.25 |
| Phase thickness (μm) | 0.25 | 0.25 | |
| Program | 50C(2min) => 6C/min => 200C => 10C/min => 270C(10min) | 60C(1min) => 5C/min => 160C => 10C/min => 250C(5min) | 60 0C (2 min) 2 0C/min -> 140 0C 1 0C/min -> 190 0C 2 0C/min -> 210 0C (28 min) |
| I | 2052. | 2056. | 2053. |
| Reference | Deng, Xu, et al., 2006 | Mockute, Nivinskiene, et al., 2003 | Pichette, Garneau, et al., 1998 |
| Comment | MSDC-RI | MSDC-RI | MSDC-RI |
References
Go To: Top, Normal alkane RI, non-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.
Kurashov, Mitrukova, et al., 2014
Kurashov, E.A.; Mitrukova, G.G.; Krylova, Yu.V.,
Variations in the component composition of essential oil of Ceratophyllum demersum (Ceratophyllaceae) during vegetation (in press),
Plant Resources (Rastitel'nye Resursy), 2014, 1, 000-000. [all data]
Kurashov, Krylova, et al., 2013
Kurashov, E.A.; Krylova, Yu.V.; Mitrukova, G.G.,
Variations in component composition of essential oil of Potamogeton pusillus (Potamogetonaceae) dirong vegetation,
Plant Resources (Rastitel'nye Resursy), 2013, 000-000. [all data]
Velickovic, Ristic, et al., 2012
Velickovic, D.T.; Ristic, M.S.; Karabegovic, I.T.; Stojicevic, S.S.; Lazic, M.L.,
The influence of the distillation method on the chemical composition of the essential oil of sage (Salvia officinalis L.),
Advanced Technologies, 2012, 1, 1, 47-51. [all data]
Yusuf and Bewaji, 2011
Yusuf, O.K.; Bewaji, C.O.,
GC-MS of volatile components of fermented wheat germ extract,
J. Cereals Oilseeds, 2011, 2, 3, 38-42. [all data]
Vichi, Aumatell, et al., 2008
Vichi, S.; Aumatell, M.R.; Buxaderas, S.; Lopez-Tamames, E.,
Assessment of some diterpenoids in commercial distilled gin,
Anal. Chim. Acta, 2008, 628, 2, 222-229, https://doi.org/10.1016/j.aca.2008.09.005
. [all data]
Deng, Xu, et al., 2006
Deng, C.; Xu, X.; Yao, N.; Li, N.; Zhang, X.,
Rapid determination of essential oil compounds in Artemisia Selengensis Turcz by gas chromatography-mass spectrometry with microwave distillation and simultaneous solid-phase microextraction,
Anal. Chim. Acta., 2006, 556, 2, 289-294, https://doi.org/10.1016/j.aca.2005.09.038
. [all data]
Mockute, Nivinskiene, et al., 2003
Mockute, D.; Nivinskiene, O.; Bernotiene, G.; Butkiene, R.,
The cis-thujone chemotype of Salvia officinalis L. essential oils,
Chemija, 2003, 14, 4, 216-220. [all data]
Pichette, Garneau, et al., 1998
Pichette, A.; Garneau, F.-X.; Jean, F.-I.; Riedl, B.; Girarg, M.,
Chemical differences between the wood extracts pf Jack pine (pinus banksiana(. blacj spruce (Picea mariana) and balsam for (Abies balsamea) from eastern Canada,
J. Wood Chem. Technol., 1998, 18, 4, 427-438, https://doi.org/10.1080/02773819809349590
. [all data]
Notes
Go To: Top, Normal alkane RI, non-polar column, custom temperature program, References
- Data from NIST Standard Reference Database 69: NIST Chemistry WebBook
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