(E)-Atlantone
- Formula: C15H22O
- Molecular weight: 218.3346
- IUPAC Standard InChI: InChI=1S/C15H22O/c1-11(2)9-15(16)10-13(4)14-7-5-12(3)6-8-14/h5,9-10,14H,6-8H2,1-4H3/b13-10+
- IUPAC Standard InChIKey: OJEFBZMKKJTKKK-JLHYYAGUSA-N
- CAS Registry Number: 108645-54-1
- 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: (S,E)-2-Methyl-6-(4-methylcyclohex-3-en-1-yl)hepta-2,5-dien-4-one; 2,5-Heptadien-4-one, 2-methyl-6-[(1S)-4-methyl-3-cyclohexen-1-yl]-, (5E)-; 2,5-Heptadien-4-one, 2-methyl-6-(4-methyl-3-cyclohexen-1-yl)-, [S-(E)]-; (-)-(E)-.α-Atlantone; (E)-α-Atlantone; α-(E)-Atlantone; trans-α-Atlantone
- Information on this page:
- Other data available:
- Options:
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 |
|---|---|---|---|---|
| Active phase | CP Sil 8 CB | CP Sil 8 CB | SE-30 | DB-5 |
| Column length (m) | 50. | 50. | 30. | |
| Carrier gas | He | He | ||
| Substrate | ||||
| Column diameter (mm) | 0.32 | 0.32 | 0.25 | |
| Phase thickness (μm) | 0.25 | 0.25 | ||
| Program | 50C(5min) => 2C/min => 90C => 15C/min => 240C(4min) | 60C(2min) => 5C/min => 160C(1min) => 10C/min => 250C (5min) | not specified | 60 0C (2 min) 2 0C/min -> 140 0C 1 0C/min -> 190 0C 2 0C/min -> 210 0C (28 min) |
| I | 1779. | 1773. | 1763. | 1772. |
| Reference | Butkienë, Nivinskienë, et al., 2004 | Judpentienë and Mockutë, 2004 | Vinogradov, 2004 | Pichette, Garneau, et al., 1998 |
| 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.
Butkienë, Nivinskienë, et al., 2004
Butkienë, R.; Nivinskienë, O.; Mockutë, D.,
Chemical composition of unripe and ripe berry essential oils of Juniperus communis L. growing wild in Vilnius district,
Chemija, 2004, 15, 4, 57-63. [all data]
Judpentienë and Mockutë, 2004
Judpentienë, A.; Mockutë, D.,
Chemical composition of essential oils of Artemisia absinthium L. (wormwood) growing wild in Vilnius,
Chemija, 2004, 15, 4, 64-68. [all data]
Vinogradov, 2004
Vinogradov, B.A.,
Production, composition, properties and application of essential oils, 2004, retrieved from http://viness.narod.ru. [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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