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2-Buten-1-one, 1-(2,6,6-trimethyl-1,3-cyclohexadien-1-yl)-, (E)-


Normal alkane RI, non-polar column, temperature ramp

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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 CapillaryCapillaryCapillaryCapillaryCapillary
Active phase Optima-5PTE-5HP-5 MSSE-54DB-5
Column length (m) 30.30.30.30.30.
Carrier gas HeliumHeliumHelium Nitrogen
Substrate      
Column diameter (mm) 0.250.250.250.320.25
Phase thickness (mum) 0.250.250.250.250.25
Tstart (C) 60.80.70.0.40.
Tend (C) 246.300.200.200.230.
Heat rate (K/min) 3.7.3.6.2.
Initial hold (min) 1.3.2.2. 
Final hold (min)  5.18.  
I 1384.1385.1388.1389.1385.
ReferenceAl-Qudah, Muhaidat, et al., 2012Fabri, Coimbra, et al., 2012Jerkovic, Hegic, et al., 2010Laselan, Buettner, et al., 2009Scrivanti, Anton, et al., 2009
Comment MSDC-RI MSDC-RI MSDC-RI MSDC-RI MSDC-RI
Column type CapillaryCapillaryCapillaryCapillaryCapillary
Active phase HP-5 MSDB-1HP-5SLB-5MSHP-5
Column length (m) 30.30.30.10.30.
Carrier gas HeliumHeHeliumHeliumHe
Substrate      
Column diameter (mm) 0.250.250.320.180.25
Phase thickness (mum) 0.250.250.250.18 
Tstart (C) 50.30.100.40.70.
Tend (C) 280.210.240.295.240.
Heat rate (K/min) 4.5.5.10.5.
Initial hold (min)   2.1.5 
Final hold (min)   5.  
I 1386.1373.1380.1384.1389.
ReferenceZhao, Zeng, et al., 2009Kumazawa, Itobe, et al., 2008Lago, Romoff, et al., 2008Risticevic, Carasek, et al., 2008Asekun, Olusegun, et al., 2007
Comment MSDC-RI MSDC-RI MSDC-RI MSDC-RI MSDC-RI
Column type CapillaryCapillaryCapillaryCapillaryCapillary
Active phase HP-5MSHP-5MSDB-5ZB-5DB-5
Column length (m) 30.30.30.30.30.
Carrier gas HeHeHe Helium
Substrate      
Column diameter (mm) 0.250.250.250.250.25
Phase thickness (mum) 0.250.250.250.250.25
Tstart (C) 60.60.40.60.60.
Tend (C) 280.250.240.220.220.
Heat rate (K/min) 3.2.3.4.4.
Initial hold (min)  8. 5. 
Final hold (min)  15. 20. 
I 1367.1379.1378.1378.1386.
ReferenceBasta, Tzakou, et al., 2007Ferhat, Tigrine-Kordjani, et al., 2007Machado, Bastos, et al., 2007Mohottalage, Tabacchi, et al., 2007Morteza-Semnani, Saeedi, et al., 2007
Comment MSDC-RI MSDC-RI MSDC-RI MSDC-RI MSDC-RI
Column type CapillaryCapillaryCapillaryCapillaryCapillary
Active phase RTX-5DB-5DB-1HP-101HP-5
Column length (m) 10.60.60.25.30.
Carrier gas HeHe HeHelium
Substrate      
Column diameter (mm) 0.180.320.250.20.32
Phase thickness (mum) 0.2 0.250.20.25
Tstart (C) 40.60.60.70.40.
Tend (C) 275.250.250.200.240.
Heat rate (K/min) 50.4.5.3.4.
Initial hold (min) 0.55. 2. 
Final hold (min) 0.5 10.15.5.
I 1394.1375.1368.1364.1373.
ReferenceSetkova, Risticevic, et al., 2007Fadel, Mageed, et al., 2006Hadian, Sonboli, et al., 2006Mastelic, Jerkovic, et al., 2006Miyazawa and Kawata, 2006
Comment MSDC-RI MSDC-RI MSDC-RI MSDC-RI MSDC-RI
Column type CapillaryCapillaryCapillaryCapillaryCapillary
Active phase DB-5DB-5DB-5HP-5 MSHP-5MS
Column length (m) 30.30.13.530.30.
Carrier gas HeHeHeHeliumHe
Substrate      
Column diameter (mm) 0.250.250.320.250.25
Phase thickness (mum) 0.250.25 0.250.25
Tstart (C) 60.40.35.60.60.
Tend (C) 220.260.225.250.280.
Heat rate (K/min) 4.2.6.2.3.
Initial hold (min)  5.3.8. 
Final hold (min)  20. 15. 
I 1387.1382.1383.1379.1359.
ReferenceMorteza-Semnani, Akbarzadeh, et al., 2006Senatore, Landolfi, et al., 2006de Souza, Vásquez, et al., 2006Tigrine-Kordiani, Meklati, et al., 2006Tzakou, Said, et al., 2006
Comment MSDC-RI MSDC-RI MSDC-RI MSDC-RI MSDC-RI
Column type CapillaryCapillaryCapillaryCapillaryCapillary
Active phase HP-5HP-5HP-5HP-5MSHP-1
Column length (m) 30.30.30.30.50.
Carrier gas HeHeHeHeHe
Substrate      
Column diameter (mm) 0.250.320.320.250.2
Phase thickness (mum) 0.250.250.250.250.5
Tstart (C) 60.60.60.60.60.
Tend (C) 250.260.260.280.250.
Heat rate (K/min) 10.5.5.3.2.
Initial hold (min) 2.2.2.  
Final hold (min) 10.14.14. 60.
I 1394.1380.1385.1360.1361.
ReferenceWang, Yang, et al., 2006Yayli, Gülec, et al., 2006Yayli, Gülec, et al., 2006Basta, Tzakou, et al., 2005Bendimerad and Bendiab, 2005
Comment MSDC-RI MSDC-RI MSDC-RI MSDC-RI MSDC-RI
Column type CapillaryCapillaryCapillaryCapillaryCapillary
Active phase SPB-5HP-5DB-5DB-5DB-1
Column length (m) 30.60.30.30.50.
Carrier gas HeHeHeHeN2
Substrate      
Column diameter (mm) 0.530.320.250.250.25
Phase thickness (mum)  0.250.250.250.25
Tstart (C) 100.30.60.60.95.
Tend (C) 250.260.220.220.240.
Heat rate (K/min) 5.2.4.4.4.
Initial hold (min)  2.5.4. 
Final hold (min)  28.   
I 1402.1390.91385.1387.1371.
ReferenceKilic, Kollmannsberger, et al., 2005Leffingwell and Alford, 2005Morteza-Semnani, Akbarzadeh, et al., 2005Morteza-Semnani and Saeedi, 2005Pala-Paul, Perez-Alonso, et al., 2005
Comment MSDC-RI MSDC-RI MSDC-RI MSDC-RI MSDC-RI
Column type CapillaryCapillaryCapillaryCapillaryCapillary
Active phase DB-5HP-5HP-5MSHP-5MSDB-1
Column length (m) 30.30.30.30.30.
Carrier gas HeHeHeHeHe
Substrate      
Column diameter (mm) 0.250.320.250.250.25
Phase thickness (mum) 0.250.250.250.250.25
Tstart (C) 40.60.60.60.50.
Tend (C) 260.260.280.280.265.
Heat rate (K/min) 2.5.3.3.2.5
Initial hold (min) 5.2.  1.
Final hold (min) 20.13.  20.
I 1382.1385.1383.1381.1351.
ReferenceSenatore, Apostolides Arnold, et al., 2005Yayli, Yasar, et al., 2005Malencic, Couladis, et al., 2004Mimica-Dukic, Bozin, et al., 2004Sarkhail, Amin, et al., 2004
Comment MSDC-RI MSDC-RI MSDC-RI MSDC-RI MSDC-RI
Column type CapillaryCapillaryCapillaryCapillaryCapillary
Active phase SE-54SPB-5OV-101HP-1DB-5
Column length (m) 30.30.12.50.30.
Carrier gas N2He HeHe
Substrate      
Column diameter (mm) 0.250.320.320.20.25
Phase thickness (mum) 0.250.250.320.50.25
Tstart (C) 40.40.35.60.60.
Tend (C) 200.220.225.220.240.
Heat rate (K/min) 5.5.6.2.3.
Initial hold (min) 4.1.3.  
Final hold (min) 10.20. 40. 
I 1380.1386.1361.1358.1382.
ReferenceTura, Prenzler, et al., 2004Ledauphin, Guichard, et al., 2003Murakami, Goldstein, et al., 2003Valette, Fernandez, et al., 2003Flamini, Ertugrul, et al., 2002
Comment MSDC-RI MSDC-RI MSDC-RI MSDC-RI MSDC-RI
Column type CapillaryCapillaryCapillaryCapillaryCapillary
Active phase DB-5DB-5DB-5Optima-1DB-5MS
Column length (m) 30.30.30.25.30.
Carrier gas HeHeHeHeHe
Substrate      
Column diameter (mm) 0.250.320.320.200.53
Phase thickness (mum) 0.250.250.250.251.5
Tstart (C) 60.40.40.50.40.
Tend (C) 240.290.230.250.225.
Heat rate (K/min) 3.7.6.3.6.
Initial hold (min)   2.3.5.
Final hold (min)   5. 30.
I 1381.1390.1395.1363.1396.
ReferenceKobaisy, Tellez, et al., 2002Lin, Rouseff, et al., 2002Sanz, Czerny, et al., 2002Brun, Bessière, et al., 2001Cadwallader and Heo, 2001
Comment MSDC-RI MSDC-RI MSDC-RI MSDC-RI MSDC-RI
Column type CapillaryCapillaryCapillaryCapillaryCapillary
Active phase HP-5DB-5MSDB-5MSDB-5DB-5
Column length (m) 30.60.30.30.30.
Carrier gas N2HeHeH2He
Substrate      
Column diameter (mm) 0.250.250.320.320.25
Phase thickness (mum) 0.250.250.250.50.25
Tstart (C) 60.40.40.60.60.
Tend (C) 220.200.195.245.240.
Heat rate (K/min) 5.2.5.3.3.
Initial hold (min) 10.5.5.3. 
Final hold (min)  30.40.20. 
I 1381.1384.1391.1395.1383.
ReferenceCampeol, Flamini, et al., 2001Lee, Suriyaphan, et al., 2001Suriyaphan, Drake, et al., 2001Kotseridis and Baumes, 2000Tellez, Dayan, et al., 2000
Comment MSDC-RI MSDC-RI MSDC-RI MSDC-RI MSDC-RI
Column type CapillaryCapillaryCapillaryCapillaryCapillary
Active phase BP-5HP-1OV-101HP-1HP-1
Column length (m) 50.25.10.25.25.
Carrier gas He Helium  
Substrate      
Column diameter (mm) 0.320.200.250.320.32
Phase thickness (mum) 1. 0.52  
Tstart (C) 40.35.35.35.35.
Tend (C) 190.250.225.250.250.
Heat rate (K/min) 2.4.6.4.4.
Initial hold (min) 5. 3.  
Final hold (min)      
I 1393.1356.1349.1356.1356.
ReferenceLopez, Ferreira, et al., 1999Ong and Acree, 1999Deibler, Acree, et al., 1998Ong and Acree, 1998Ong, Acree, et al., 1998
Comment MSDC-RI MSDC-RI MSDC-RI MSDC-RI MSDC-RI
Column type CapillaryCapillaryCapillaryCapillaryCapillary
Active phase OV-101OV-101OV-101OV-101DB-5
Column length (m) 12.12.15.15.30.
Carrier gas   HeHeH2
Substrate      
Column diameter (mm) 0.320.320.320.320.32
Phase thickness (mum)     1.
Tstart (C) 35.35.35.35.40.
Tend (C) 225.225.250.250.220.
Heat rate (K/min) 6.6.6.6.3.
Initial hold (min) 3.3.3.3. 
Final hold (min)      
I 1352.1353.1356.1360.1390.
ReferenceRoberts and Acree, 1996Roberts and Acree, 1996Chisholm, Guiher, et al., 1995Chisholm, Guiher, et al., 1995Moio, Dekimpe, et al., 1993
Comment MSDC-RI MSDC-RI MSDC-RI MSDC-RI MSDC-RI
Column type PackedCapillaryCapillaryCapillaryCapillary
Active phase SE-54DB-1DB-1DB-1HP-5
Column length (m) 3.60.60.60.50.
Carrier gas    HeH2
Substrate Chromosorb G AW DMCS (100-120 mesh)    
Column diameter (mm)  0.32 0.250.3
Phase thickness (mum)      
Tstart (C) 50.50.30.30.80.
Tend (C) 230.230.200.200.250.
Heat rate (K/min) 6.4.4.4.16.
Initial hold (min) 2. 25.25. 
Final hold (min) 10.10.30.5. 
I 1389.1360.1360.1360.1371.
ReferenceSchieberle, 1991Binder, Turner, et al., 1990Buttery, Takeoka, et al., 1990Buttery, Teranishi, et al., 1990Spadone, Takeoka, et al., 1990
Comment MSDC-RI MSDC-RI MSDC-RI MSDC-RI MSDC-RI
Column type CapillaryCapillaryCapillaryCapillaryCapillary
Active phase HP-5OV-101OV-101DB-5DB-1
Column length (m) 50.50.50.30.50.
Carrier gas H2N2N2Hydrogen 
Substrate      
Column diameter (mm) 0.30.250.250.350.32
Phase thickness (mum)    1.0 
Tstart (C) 80.80.80.45.0.
Tend (C) 250.200.200.220.250.
Heat rate (K/min) 16.2.2.2.3.
Initial hold (min)      
Final hold (min)      
I 1397.1360.1367.1396.1360.
ReferenceSpadone, Takeoka, et al., 1990Yang and Sugisawa, 1990Yang and Sugisawa, 1990Georgilopoulos and Gallois, 1988Habu, Flath, et al., 1985
Comment MSDC-RI MSDC-RI MSDC-RI MSDC-RI MSDC-RI
Column type Capillary
Active phase DB-1
Column length (m) 50.
Carrier gas  
Substrate  
Column diameter (mm) 0.32
Phase thickness (mum)  
Tstart (C) 50.
Tend (C) 250.
Heat rate (K/min) 3.
Initial hold (min)  
Final hold (min)  
I 1360.
ReferenceHabu, Flath, et al., 1985
Comment 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.

Al-Qudah, Muhaidat, et al., 2012
Al-Qudah, M.A.; Muhaidat, R.; Trawenh, I.N.; Jaber, H.I.; Abu Zarga, M.H.; Abu Orabi, S.T., Volatile constituents of leaves and bulbs of Gynandriris Sisyrinchicum and their antimicrobial activities, Jordan J. Chem., 2012, 7, 3, 287-295. [all data]

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Bendimerad, N.; Bendiab, S.A.T., Composition and antibacterial activity of Pseudocytisus integrifolius (Salisb.) essential oil from Algeria, J. Agric. Food Chem., 2005, 53, 8, 2947-2952, https://doi.org/10.1021/jf047937u . [all data]

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Morteza-Semnani, Akbarzadeh, et al., 2005
Morteza-Semnani, K.; Akbarzadeh, M.; Rostami, B., The essential oil composition of Teucrium chamaedrys L. from Iran, Flavour Fragr. J., 2005, 20, 5, 544-546, https://doi.org/10.1002/ffj.1479 . [all data]

Morteza-Semnani and Saeedi, 2005
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Notes

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