Cyclohexanone, 5-methyl-2-(1-methylethyl)-, trans-


Van Den Dool and Kratz 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 CapillaryCapillaryCapillaryCapillaryCapillary
Active phase HP-5BP-1HP-5MSHP-5MSCP Sil 5 CB
Column length (m) 30.50.30.30.25.
Carrier gas HeHeHeHeH2
Substrate      
Column diameter (mm) 0.250.220.250.250.25
Phase thickness (μm) 0.250.250.250.25 
Tstart (C) 40.60.60.60.80.
Tend (C) 250.220.280.280.270.
Heat rate (K/min) 5.2.3.3.10.
Initial hold (min) 1.    
Final hold (min) 10.20.   
I 1155.1133.1154.1150.1136.
ReferenceBenzo, Gilardoni, et al., 2007Castilho, Liu, et al., 2007Vagionas, Ngassapa, et al., 2007Kukic J., Petrovic S., et al., 2006Ziegenbein, Hanssen, et al., 2006
Comment MSDC-RI MSDC-RI MSDC-RI MSDC-RI MSDC-RI
Column type CapillaryCapillaryCapillaryCapillaryCapillary
Active phase DB-5DB-1HP-5MSHP-5DB-5
Column length (m) 30.30.30.30.30.
Carrier gas HeHeHeHeHe
Substrate      
Column diameter (mm) 0.250.250.250.250.25
Phase thickness (μm) 0.250.250.250.250.25
Tstart (C) 90.40.60.40.60.
Tend (C) 220.260.250.240.240.
Heat rate (K/min) 4.2.4.3.3.
Initial hold (min) 2.5.2.  
Final hold (min)  20.20.  
I 1163.1125.1154.1153.1156.
ReferenceAgnihotri, Agarwal, et al., 2005de Feo, Urrunaga Soria, et al., 2005Pino, Mesa, et al., 2005Shellie and Marriott, 2003Tampieri, Galuppi, et al., 2003
Comment MSDC-RI MSDC-RI MSDC-RI MSDC-RI MSDC-RI
Column type CapillaryCapillaryCapillaryCapillaryCapillary
Active phase SPB-5DB-5CP Sil 5 CBBPX-5BP-1
Column length (m) 30.30.50.50.50.
Carrier gas HeH2HeH2 
Substrate      
Column diameter (mm) 0.250.250.320.220.22
Phase thickness (μm) 0.250.250.40.250.25
Tstart (C) 60.60.60.60.60.
Tend (C) 250.240.280.180.220.
Heat rate (K/min) 4.3.3.4.2.
Initial hold (min) 2. 10.5. 
Final hold (min) 20. 60.5.20.
I 1154.1152.1131.1176.1135.
ReferencePino, Marbot, et al., 2002Nogueira, Bittrich, et al., 2001Pino and Marbot, 2001Zabaras and Wyllie, 2001Baldovini, Ristorcelli, et al., 2000
Comment MSDC-RI MSDC-RI MSDC-RI MSDC-RI MSDC-RI
Column type CapillaryCapillaryCapillaryCapillaryCapillary
Active phase OV-101OV-101OV-101OV-101OV-101
Column length (m) 25.25.25.25.25.
Carrier gas HeHeHeHeHe
Substrate      
Column diameter (mm) 0.200.200.200.200.20
Phase thickness (μm)      
Tstart (C) 60.60.60.60.60.
Tend (C) 260.260.260.260.260.
Heat rate (K/min) 1.1.2.2.2.
Initial hold (min) 8.8.0.0.8.
Final hold (min) 30.30.30.30.30.
I 1127.1130.1132.1139.1131.
ReferenceBaaliouamer, Boudarene, et al., 1993Baaliouamer, Boudarene, et al., 1993Baaliouamer, Boudarene, et al., 1993Baaliouamer, Boudarene, et al., 1993Baaliouamer, Boudarene, et al., 1993
Comment MSDC-RI MSDC-RI MSDC-RI MSDC-RI MSDC-RI
Column type CapillaryCapillaryCapillaryCapillaryCapillary
Active phase OV-101OV-101OV-101OV-101OV-101
Column length (m) 25.25.25.25.25.
Carrier gas HeHeHeHeHe
Substrate      
Column diameter (mm) 0.200.200.200.200.20
Phase thickness (μm)      
Tstart (C) 60.60.60.60.60.
Tend (C) 260.260.260.260.260.
Heat rate (K/min) 2.2.2.4.4.
Initial hold (min) 8.8.8.8.8.
Final hold (min) 30.30.30.30.30.
I 1131.1134.1134.1135.1137.
ReferenceBaaliouamer, Boudarene, et al., 1993Baaliouamer, Boudarene, et al., 1993Baaliouamer, Boudarene, et al., 1993Baaliouamer, Boudarene, et al., 1993Baaliouamer, Boudarene, et al., 1993
Comment MSDC-RI MSDC-RI MSDC-RI MSDC-RI MSDC-RI
Column type CapillaryCapillaryCapillaryCapillary
Active phase OV-101OV-101OV-101OV-101
Column length (m) 25.25.25.25.
Carrier gas HeHeHeHe
Substrate     
Column diameter (mm) 0.200.200.200.20
Phase thickness (μm)     
Tstart (C) 70.70.80.80.
Tend (C) 260.260.260.260.
Heat rate (K/min) 2.2.2.2.
Initial hold (min) 8.8.8.8.
Final hold (min) 30.30.30.30.
I 1131.1136.1135.1139.
ReferenceBaaliouamer, Boudarene, et al., 1993Baaliouamer, Boudarene, et al., 1993Baaliouamer, Boudarene, et al., 1993Baaliouamer, Boudarene, et al., 1993
Comment MSDC-RI MSDC-RI MSDC-RI MSDC-RI

References

Go To: Top, Van Den Dool and Kratz 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.

Benzo, Gilardoni, et al., 2007
Benzo, M.; Gilardoni, G.; Gandini, C.; Caccialanza, G.; Finzi, P.V.; Vidari, G.; Abdo, S.; Layedra, P., Determination of the threshold odor concentration of main odorants in essential oils using gas chromatography-olfactometry incremental dilution technique, J. Chromatogr. A, 2007, 1150, 1-2, 131-135, https://doi.org/10.1016/j.chroma.2007.02.031 . [all data]

Castilho, Liu, et al., 2007
Castilho, P.; Liu, K.; Rodrigues, A.I.; Feio, S.; Tomi, F.; Casanova, J., Composition and antimicrobial activity of the essential oil of Clinopodium ascendens (Jordan) Sampaio from Madeira, Flavour Fragr. J., 2007, 22, 2, 139-144, https://doi.org/10.1002/ffj.1771 . [all data]

Vagionas, Ngassapa, et al., 2007
Vagionas, K.; Ngassapa, O.; Runyoro, D.; Graikou, K.; Gortzi, O.; Chinou, I., Chemical analysis of edible aromatic plants growing in Tanzania, Food Chem., 2007, 105, 4, 1711-1717, https://doi.org/10.1016/j.foodchem.2007.05.029 . [all data]

Kukic J., Petrovic S., et al., 2006
Kukic J.; Petrovic S.; Pavlovic M.; Couladis M.; Tzakou O.; Niketic M., Composition of essential oil of Stachys alpina L. ssp dinarica Murb., Flavour Fragr. J., 2006, 21, 3, 539-542, https://doi.org/10.1002/ffj.1684 . [all data]

Ziegenbein, Hanssen, et al., 2006
Ziegenbein, F.C.; Hanssen, H.-P.; König, W.A., Secondary metabolites from Ganoderma lucidum and Spongiporus leucomallellus, Phytochemistry, 2006, 67, 2, 202-211, https://doi.org/10.1016/j.phytochem.2005.10.025 . [all data]

Agnihotri, Agarwal, et al., 2005
Agnihotri, V.K.; Agarwal, S.G.; Dhar, P.L.; Thappa, R.K.; Baleshwar; Kapahi, B.K.; Saxena, R.K.; Qazi, G.N., Essential oil composition of Mentha pulegium L. growing wild in the north-western Himalayas India, Flavour Fragr. J., 2005, 20, 6, 607-610, https://doi.org/10.1002/ffj.1497 . [all data]

de Feo, Urrunaga Soria, et al., 2005
de Feo, V.; Urrunaga Soria, E.; Urrunaga Soria, R.; Pizza, C., Composition and in vitro toxicity of the essential oil of Tagetes terniflora HBK. (Asteraceae), Flavour Fragr. J., 2005, 20, 1, 89-92, https://doi.org/10.1002/ffj.1379 . [all data]

Pino, Mesa, et al., 2005
Pino, J.A.; Mesa, J.; Muñoz, Y.; Martí, M.P.; Marbot, R., Volatile components from mango (Mangifera indica L.) cultivars, J. Agric. Food Chem., 2005, 53, 6, 2213-2223, https://doi.org/10.1021/jf0402633 . [all data]

Shellie and Marriott, 2003
Shellie, R.A.; Marriott, P.J., Comprehensive two-dimensional gas chromatography-mass spectrometry analysis of Pelargonium graveolens essential oil using rapid scanning quadrupole mass spectrometry, Analyst, 2003, 128, 7, 879-883, https://doi.org/10.1039/b304371a . [all data]

Tampieri, Galuppi, et al., 2003
Tampieri, M.P.; Galuppi, R.; Carelle, M.S.; Macchioni, F.; Cioni, P.L.; Morelli, I., Effect of selected essential oils and pure compounds on Saprolegnia parasitica, Pharm. Biol., 2003, 41, 8, 584-591, https://doi.org/10.1080/13880200390501839 . [all data]

Pino, Marbot, et al., 2002
Pino, J.; Marbot, R.; Rosado, A., Volatile constituents of star apple (Chrysophyllum cainito L.) from Cuba, Flavour Fragr. J., 2002, 17, 5, 401-403, https://doi.org/10.1002/ffj.1116 . [all data]

Nogueira, Bittrich, et al., 2001
Nogueira, P.C.L.; Bittrich, V.; Shepherd, G.J.; Lopes, A.V.; Marsaioli, A.J., The ecological and taxonomic importance of flower volatiles of Clusia species (Guttiferae), Phytochemistry, 2001, 56, 5, 443-452, https://doi.org/10.1016/S0031-9422(00)00213-2 . [all data]

Pino and Marbot, 2001
Pino, J.A.; Marbot, R., Volatile flavor constituents of acerola (Malpighia emarginata DC.) fruit, J. Agric. Food Chem., 2001, 49, 12, 5880-5882, https://doi.org/10.1021/jf010270g . [all data]

Zabaras and Wyllie, 2001
Zabaras, D.; Wyllie, S.G., Quantitative analysis of terpenoids in the gas phase using headspace solid-phase microextraction (HS-SPME), Flavour Fragr. J., 2001, 16, 6, 411-416, https://doi.org/10.1002/ffj.1025 . [all data]

Baldovini, Ristorcelli, et al., 2000
Baldovini, N.; Ristorcelli, D.; Tomi, F.; Casanova, J., Infraspecific variability of the essential oil of Calamintha nepeta from Corsica (France), Flavour Fragr. J., 2000, 15, 1, 50-54, https://doi.org/10.1002/(SICI)1099-1026(200001/02)15:1<50::AID-FFJ871>3.0.CO;2-F . [all data]

Baaliouamer, Boudarene, et al., 1993
Baaliouamer, A.; Boudarene, L.; Meklati, B.Y., Use of local lagrange interpolation of calculation of retention indices in linear temperature-programmed gas chromatrography, Chromatographia, 1993, 35, 1/2, 67-72, https://doi.org/10.1007/BF02278559 . [all data]


Notes

Go To: Top, Van Den Dool and Kratz RI, non-polar column, temperature ramp, References