(1S,4aS,7R,8aS)-1,4a-Dimethyl-7-(prop-1-en-2-yl)decahydronaphthalen-1-ol
- Formula: C15H26O
- Molecular weight: 222.3663
- IUPAC Standard InChI: InChI=1S/C15H26O/c1-11(2)12-6-9-14(3)7-5-8-15(4,16)13(14)10-12/h12-13,16H,1,5-10H2,2-4H3
- IUPAC Standard InChIKey: DPQYOKVMVCQHMY-UHFFFAOYSA-N
- CAS Registry Number: 6168-59-8
- 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. - Species with the same structure:
- Stereoisomers:
- Other names: 1-Naphthalenol, decahydro-1,4a-dimethyl-7-(1-methylethenyl)-, (1S,4aS,7R,8aS)-; 5β,10α-Eudesm-11-en-4-ol; Intermedeol; (+)-Intermedeol
- Information on this page:
- Other data available:
- Options:
Normal alkane RI, non-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 | DB-5 | CP Sil 5 CB | HP-5 | HP-5 | RTX-5Sil |
| Column length (m) | 30. | 30. | 30. | 30. | 30. |
| Carrier gas | Nitrogen | N2 | He | Helium | He |
| Substrate | |||||
| Column diameter (mm) | 0.25 | 0.32 | 0.25 | 0.32 | 0.25 |
| Phase thickness (μm) | 0.25 | 0.25 | 0.25 | 0.25 | 0.25 |
| Tstart (C) | 40. | 60. | 50. | 40. | 70. |
| Tend (C) | 230. | 300. | 300. | 300. | 200. |
| Heat rate (K/min) | 2. | 4. | 5. | 4. | 4. |
| Initial hold (min) | 5. | ||||
| Final hold (min) | 5. | 5. | 10. | ||
| I | 1667. | 1646. | 1666. | 1667. | 1677. |
| Reference | Scrivanti, Anton, et al., 2009 | Baran, von Reuss, et al., 2007 | Figuérédo, Cabassu, et al., 2006 | Utsunomia, Kawata, et al., 2005 | Dudai, Larkov, et al., 2003 |
| Comment | MSDC-RI | MSDC-RI | MSDC-RI | MSDC-RI | MSDC-RI |
| Column type | Capillary | Capillary | Capillary |
|---|---|---|---|
| Active phase | DB-5 | DB-1 | DB-1 |
| Column length (m) | 30. | 60. | |
| Carrier gas | He | Hydrogen | |
| Substrate | |||
| Column diameter (mm) | 0.32 | 0.25 | |
| Phase thickness (μm) | 0.25 | ||
| Tstart (C) | 60. | 80. | 50. |
| Tend (C) | 250. | 220. | 238. |
| Heat rate (K/min) | 3. | 6. | 4. |
| Initial hold (min) | |||
| Final hold (min) | 8. | ||
| I | 1654. | 1629. | 1647. |
| Reference | Abreu and Noronha, 1997 | Salgueiro, Vila, et al., 1997 | Kesselmans and Wijnberg, 1992 |
| Comment | MSDC-RI | MSDC-RI | MSDC-RI |
References
Go To: Top, Normal alkane RI, non-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.
Scrivanti, Anton, et al., 2009
Scrivanti, L.R.; Anton, A.M.; Zygadlo, J.A.,
Essential oil conposition of Bothriochloa Kuntze (Poaceae) from South America and their chemotaxonomy,
Biochem. Systematics Ecol., 2009, 37, 3, 206-213, https://doi.org/10.1016/j.bse.2009.03.009
. [all data]
Baran, von Reuss, et al., 2007
Baran, S.; von Reuss, S.H.; König, W.A.; Kalemba, D.,
Composition of the essential oil of Abies koreana Wils.,
Flavour Fragr. J., 2007, 22, 1, 78-83, https://doi.org/10.1002/ffj.1762
. [all data]
Figuérédo, Cabassu, et al., 2006
Figuérédo, G.; Cabassu, P.; Chalchat, J.-C.; Pasquier, B.,
Studies of Mediterranean oregano populations. VIII. Chemical composition of essential oils of oreganos of various origins,
Flavour Fragr. J., 2006, 21, 1, 134-139, https://doi.org/10.1002/ffj.1543
. [all data]
Utsunomia, Kawata, et al., 2005
Utsunomia, H.; Kawata, J.; Chanoki, W.; Shirakawa, N.; Miyazawa, M.,
Components of Essential Oil from Woods of Prunus mume Sieb. at Zucc.,
J. Oleo Sci., 2005, 54, 11, 609-612, https://doi.org/10.5650/jos.54.609
. [all data]
Dudai, Larkov, et al., 2003
Dudai, N.; Larkov, O.; Chaimovitsh, D.; Lewinsohn, E.; Freiman, L.; Ravid, U.,
Essential oil compounds of Origanum dayi Post,
Flavour Fragr. J., 2003, 18, 4, 334-337, https://doi.org/10.1002/ffj.1237
. [all data]
Abreu and Noronha, 1997
Abreu, P.M.; Noronha, R.G.,
Volatile constituents of the rhizomes of Aframomum alboviolaceum (Ridley) K. Schum. from Guinea-Bissau,
Flavour Fragr. J., 1997, 12, 2, 79-83, https://doi.org/10.1002/(SICI)1099-1026(199703)12:2<79::AID-FFJ617>3.0.CO;2-7
. [all data]
Salgueiro, Vila, et al., 1997
Salgueiro, L.R.; Vila, R.; Tomi, F.; Figueiredo, A.C.; Barroso, J.G.; Cañigueral, S.; Casanova, J.; da Cunha, A.P.; Adzet, T.,
Variability of essential oils of Thymus caespititius from Portugal,
Phytochemistry, 1997, 45, 2, 307-311, https://doi.org/10.1016/S0031-9422(96)00872-2
. [all data]
Kesselmans and Wijnberg, 1992
Kesselmans, R.P.W.; Wijnberg, J.B.P.A.,
Chromatographic and spectroscopic data of all stereoisomers of eudesm-11-en-4-ol,
J. Essent. Oil Res., 1992, 4, 3, 201-217, https://doi.org/10.1080/10412905.1992.9698050
. [all data]
Notes
Go To: Top, Normal alkane RI, non-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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