6-Octen-1-ol, 3,7-dimethyl-, formate
- Formula: C11H20O2
- Molecular weight: 184.2753
- IUPAC Standard InChIKey: DZNVIZQPWLDQHI-UHFFFAOYSA-N
- CAS Registry Number: 105-85-1
- 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. - Other names: Citronellyl formate; Formic acid, citronellyl ester; Formic acid, 3,7-dimethyl-6-octen-1-yl ester; 2,6-Dimethyl-2-octen-8-yl formate; 3,7-Dimethyl-6-octen-1-yl formate; 3,7-Dimethyloct-6-en-1-yl formate; 3,7-Dimethyl-6-octenyl formate; Citronelyl formate
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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 | HP-5 MS | HP-5 MS | DB-5 | FSOT-RSL-200 |
Column length (m) | 30. | 30. | 30. | 60. | 30. |
Carrier gas | Helium | Helium | Helium | Nitrogen | Hydrogen |
Substrate | |||||
Column diameter (mm) | 0.25 | 0.25 | 0.25 | 0.25 | 0.32 |
Phase thickness (μm) | 0.25 | 0.25 | 0.25 | 0.25 | 0.25 |
Tstart (C) | 100. | 50. | 40. | 60. | 40. |
Tend (C) | 260. | 180. | 260. | 250. | 280. |
Heat rate (K/min) | 10. | 2. | 4. | 5. | 6. |
Initial hold (min) | 1. | 5. | |||
Final hold (min) | 10. | 5. | 10. | 5. | |
I | 1282. | 1273. | 1273. | 1278. | 1274. |
Reference | Boukhris, Bouaziz, et al., 2012 | Phungpanya, Thongpoon, et al., 2012 | Miyazawa, Marumoto, et al., 2011 | Mosayebi, Amin, et al., 2008 | Jirovetz, Eller, et al., 2006 |
Comment | MSDC-RI | MSDC-RI | MSDC-RI | MSDC-RI | MSDC-RI |
Column type | Capillary | Capillary | Capillary | Capillary |
---|---|---|---|---|
Active phase | CP Sil 5 CB | BP-1 | DB-5 | DB-1 |
Column length (m) | 25. | 30. | 30. | 60. |
Carrier gas | N2 | He | He | |
Substrate | ||||
Column diameter (mm) | 0.25 | 0.25 | 0.25 | 0.32 |
Phase thickness (μm) | 0.25 | 0.25 | 0.25 | |
Tstart (C) | 50. | 60. | 50. | 80. |
Tend (C) | 230. | 220. | 250. | 210. |
Heat rate (K/min) | 3. | 5. | 2. | 4. |
Initial hold (min) | 5. | |||
Final hold (min) | ||||
I | 1252. | 1260. | 1249. | 1263. |
Reference | Tesso, Kubeczka, et al., 2006 | Gupta, Mallavarapu, et al., 2001 | Reverchon, Porta, et al., 1997 | Nishimura, 1995 |
Comment | MSDC-RI | 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.
Boukhris, Bouaziz, et al., 2012
Boukhris, M.; Bouaziz, M.; Feki, I.; Jemai, H.; El Feki, A.; Sayadi, S.,
Hypoglycemic and antioxidant effects of leaf essential oil of Pelargonium graveolens L'Her. in alloxan induced diabetic rats,
Lipids in Health and Disease, 2012, 11, 1, 1-10, https://doi.org/10.1186/1476-511X-11-81
. [all data]
Phungpanya, Thongpoon, et al., 2012
Phungpanya, C.; Thongpoon, C.; Pripdeevech, P.; Machan, T.,
Analysis of aroma volatiles from fresh leaves of Plectranthus amboinicus using solid phase microextraction (SPME) technique, Pure and Applied Chemistry International Conference 2012 (PACCON 2012), 2012, 16701672. [all data]
Miyazawa, Marumoto, et al., 2011
Miyazawa, M.; Marumoto, S.; Kobayashi, T.; Yoshida, S.; Utsumi, Y.,
Determination of characteristic components in essential oils from Wisteria braphybotrys using gas chromatography - olfactometry incremental dilution technique,
Rec. Nat. Prod., 2011, 5, 3, 221-227. [all data]
Mosayebi, Amin, et al., 2008
Mosayebi, M.; Amin, G.; Arzani, H.; Azarnivand, H.; Maleki, M.; Shafaghat, A.,
Effect of habitat on essential oil of Achillea filipendula L. in Iran,
Asian J. Plant Sci., 2008, 7, 8, 779-781, https://doi.org/10.3923/ajps.2008.779.781
. [all data]
Jirovetz, Eller, et al., 2006
Jirovetz, L.; Eller, G.; Buchbauer, G.; Schmidt, E.; Denkova, Z.; Stoyanova, A.S.; Nikolova R.; Geissler, M.,
Chemical composition, antimicrobial activities and odor descriptions of some essential oils with characteristic floral-rosy scent and of their principal aroma compounds,
Recent. Res. Devel. Agronomy Horticulture, 2006, 2, 1-12. [all data]
Tesso, Kubeczka, et al., 2006
Tesso, H.; Kubeczka, K.-H.; König, W.A.,
A new phthalide from the essential oil of Meum athamanticum,
Flavour Fragr. J., 2006, 21, 4, 622-625, https://doi.org/10.1002/ffj.1629
. [all data]
Gupta, Mallavarapu, et al., 2001
Gupta, R.; Mallavarapu, G.R.; Banerjee, S.; Kumar, S.,
Characteristics of an isomenthone-rich somaclonal mutant isolated in a geraniol-rich rose-scented geranium accession of Pelargonium graveolens,
Flavour Fragr. J., 2001, 16, 5, 319-324, https://doi.org/10.1002/ffj.1002
. [all data]
Reverchon, Porta, et al., 1997
Reverchon, E.; Porta, G.D.; Gorgoglione, D.,
Supercritical CO2 extraction of volatile oil from rose concrete,
Flavour Fragr. J., 1997, 12, 1, 37-41, https://doi.org/10.1002/(SICI)1099-1026(199701)12:1<37::AID-FFJ605>3.0.CO;2-V
. [all data]
Nishimura, 1995
Nishimura, O.,
Application of a thermal desorption cold trap injector to multidimensional GC and GC-MS,
J. Hi. Res. Chromatogr., 1995, 18, 11, 699-704, https://doi.org/10.1002/jhrc.1240181105
. [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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