Bicyclo[3.1.1]hept-3-en-2-ol, 4,6,6-trimethyl-, [1S-(1α,2β,5α)]-
- Formula: C10H16O
- Molecular weight: 152.2334
- IUPAC Standard InChI: InChI=1S/C10H16O/c1-6-4-9(11)8-5-7(6)10(8,2)3/h4,7-9,11H,5H2,1-3H3/t7?,8?,9-/m1/s1
- IUPAC Standard InChIKey: WONIGEXYPVIKFS-AMDVSUOASA-N
- CAS Registry Number: 18881-04-4
- 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. - Stereoisomers:
- Other names: (S)-cis-Verbenol; (-)-(Z)-Verbenol; Bicyclo(3.1.1)hept-3-en-2-ol, 4,6,6-trimethyl-, (1S,2S,5S)-; (1S-(1α,2β,5α))-4,6,6-Trimethylbicyclo(3.1.1)hept-3-en-2-ol; S-(-)-cis-Verbenol; (-)-Verbenol; (-)-cis-Verbenol; cis-Verbenol
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Normal alkane RI, non-polar column, custom temperature program
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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 |
|---|---|---|---|---|
| Active phase | DB-1 | RTX-1 | HP-5 | DB-5 |
| Column length (m) | 30. | 60. | 30. | 50. |
| Carrier gas | Hydrogen | Helium | Nitrogen | Helium |
| Substrate | ||||
| Column diameter (mm) | 0.25 | 0.22 | 0.35 | 0.32 |
| Phase thickness (μm) | 0.25 | 0.25 | 0.25 | 0.25 |
| Program | 45 0C 3 0C/min -> 175 0C 15 0C/min -> 300 0C (10 min) | not specified | 60 0C 3 0C/min -> 210 0C 5 0C/min -> 250 0C (2 min) | 60 0C (1 min) 5 0C/min -> 160 0C 10 0C/min -> 250 0C |
| I | 1110. | 1132. | 1142. | 1141. |
| Reference | Albano, Lima, et al., 2012 | Bendiabdellah, El Amine Dib, et al., 2012 | Veres, Csupor-Loffler, et al., 2012 | Nivinsliene, Butkiene, et al., 2007 |
| Comment | MSDC-RI | 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.
Albano, Lima, et al., 2012
Albano, S.M.; Lima, A.S.; Miguel, M.G.; Pedro, L.G.; Barroso, J.G.; Figueiredo, A.C.,
Antioxidant, anti-5-lipoxygenase and antiacetylcholinesterase activities of essential oils and decoction water of some aromatic plants,
Rec. Nat. Prod., 2012, 6, 1, 35-48. [all data]
Bendiabdellah, El Amine Dib, et al., 2012
Bendiabdellah, A.; El Amine Dib, M.; Djabou, N.; Allali, H.; Tabti, B.; Costa, J.; Myseli, A.,
Biological activities and volatile cinstituents of Daucus muricatus L. from Algeria,
Chem. Centr. J., 2012, 6, 48, 1-22. [all data]
Veres, Csupor-Loffler, et al., 2012
Veres, K.; Csupor-Loffler, B.; Lazar, A.; Holmann, J.,
Antifungal activity and composition of essential oils of Conyza canadensis herbs and roots,
The Sci. World. J., 2012, 2012, 1-5, https://doi.org/10.1100/2012/489646
. [all data]
Nivinsliene, Butkiene, et al., 2007
Nivinsliene, O.; Butkiene, R.; Gudalevic, A.; Mockute, D.; Meskauskiene, V.; Grigaliunaite, B.,
Influence of urban environment on chemical composition of Tilia cordata essential oil,
Chemija, 2007, 18, 1, 44-49. [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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