1-Octen-3-one


Normal alkane RI, 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 AT-WaxDB-WaxTC-WaxFFAPDB-Wax
Column length (m) 60.30.60.30.30.
Carrier gas HeliumHeliumHeliumHeliumHydrogen
Substrate      
Column diameter (mm) 0.250.250.250.320.25
Phase thickness (μm) 0.250.25 0.250.25
Tstart (C) 60.40.40.40.30.
Tend (C) 280.210.230.240.230.
Heat rate (K/min) 4.3.3.6.8.
Initial hold (min)   3.2.5.
Final hold (min)     10.
I 1274.1298.1320.1295.1310.
ReferenceKiss, Csoka, et al., 2011Kumazawa, Sakai, et al., 2010Miyazawa, Fujita, et al., 2010Christlbauer and Schieberle, 2009Karlsson, Birgersson, et al., 2009
Comment MSDC-RI MSDC-RI MSDC-RI MSDC-RI MSDC-RI
Column type CapillaryCapillaryCapillaryCapillaryCapillary
Active phase DB-FFAPTC-WAXDB-WaxDB-WaxDB-Wax
Column length (m) 30.60.30.30.30.
Carrier gas  HeliumHeliumHeliumHelium
Substrate      
Column diameter (mm) 0.320.250.250.250.25
Phase thickness (μm) 0.25 0.250.250.25
Tstart (C) 0.40.60.60.60.
Tend (C) 200.230.200.200.200.
Heat rate (K/min) 6.3.8.8.8.
Initial hold (min) 2.3.3.3.3.
Final hold (min)   9.59.59.5
I 1297.1300.1310.1313.1327.
ReferenceLaselan, Buettner, et al., 2009Miyazawa, Tomita, et al., 2009Rochat, Egger, et al., 2009Rochat, Egger, et al., 2009Rochat, Egger, et al., 2009
Comment MSDC-RI MSDC-RI MSDC-RI MSDC-RI MSDC-RI
Column type CapillaryCapillaryCapillaryCapillaryCapillary
Active phase DB-WaxDB-WaxStabilwaxDB-WaxCP-Wax 52CB
Column length (m) 30.60.30.60.60.
Carrier gas HeliumHeliumHelium He
Substrate      
Column diameter (mm) 0.250.250.250.350.32
Phase thickness (μm) 0.250.250.50 0.5
Tstart (C) 60.50.35.40.40.
Tend (C) 200.220.225.200.220.
Heat rate (K/min) 8.3.6.4.4.
Initial hold (min) 3.2.5. 8.
Final hold (min) 9.570.10. 20.
I 1331.1300.1296.1309.1309.
ReferenceRochat, Egger, et al., 2009Shimizu, Imayoshi, et al., 2009Watcharananun, Cadwallader, et al., 2009Ganeko, Shoda, et al., 2008Povolo, Contarini, et al., 2007
Comment MSDC-RI MSDC-RI MSDC-RI MSDC-RI MSDC-RI
Column type CapillaryCapillaryCapillaryCapillaryCapillary
Active phase DB-WaxDB-FFAPBP-20HP-InnowaxDB-Wax
Column length (m) 30.30.50.60.60.
Carrier gas HeHeH2HeHelium
Substrate      
Column diameter (mm) 0.250.320.220.320.25
Phase thickness (μm) 0.250.250.250.50.25
Tstart (C) 40.40.45.60.35.
Tend (C) 230.230.230.220.240.
Heat rate (K/min) 4.6.3.2.6.
Initial hold (min) 2.1.1. 3.
Final hold (min) 5. 15.10.10.
I 1305.1300.1290.1315.1304.
ReferenceXu, Fan, et al., 2007Zeller and Rychlik, 2007La Guerche S., Dauphin B., et al., 2006Senger-Emonnot, Rochard, et al., 2006Spadone, Matthey-Doret, et al., 2006
Comment MSDC-RI MSDC-RI MSDC-RI MSDC-RI MSDC-RI
Column type CapillaryCapillaryCapillaryCapillaryCapillary
Active phase Supelcowax-10Supelcowax-10Supelcowax-10ZB-WaxZB-Wax
Column length (m) 60.60.60.30.30.
Carrier gas HeHeHeHeliumHelium
Substrate      
Column diameter (mm) 0.530.530.530.320.32
Phase thickness (μm) 1.1.1.0.250.25
Tstart (C) 40.40.40.40.40.
Tend (C) 240.240.240.250.250.
Heat rate (K/min) 4.4.4.5.5.
Initial hold (min) 2.2.2.2.2.
Final hold (min) 20.20.20.5.5.
I 1324.1324.1328.1279.1282.
ReferenceRochat and Chaintreau, 2005Rochat and Chaintreau, 2005Rochat and Chaintreau, 2005N/AN/A
Comment MSDC-RI MSDC-RI MSDC-RI MSDC-RI MSDC-RI
Column type CapillaryCapillaryCapillaryCapillaryCapillary
Active phase ZB-WaxDB-WaxZB-WaxDB-WaxDB-Wax
Column length (m) 30.30.30.30.60.
Carrier gas HeH2HeH2He
Substrate      
Column diameter (mm) 0.320.320.320.320.25
Phase thickness (μm) 0.250.250.250.50.25
Tstart (C) 40.40.40.40.40.
Tend (C) 250.230.250.200.220.
Heat rate (K/min) 5.5.5.4.3.
Initial hold (min) 2.2.2.5.5.
Final hold (min) 10.15.10.  
I 1282.1279.1282.1317.1309.
ReferenceWu, Krings, et al., 2005Wu, Krings, et al., 2005Wu, Krings, et al., 2005Culleré, Escudero, et al., 2004López, Ezpeleta, et al., 2004
Comment MSDC-RI MSDC-RI MSDC-RI MSDC-RI MSDC-RI
Column type CapillaryCapillaryCapillaryCapillaryCapillary
Active phase HP-FFAPDB-WaxDB-FFAPBP-20DB-Wax
Column length (m) 30.30.30.50.30.
Carrier gas HeH2H2H2He
Substrate      
Column diameter (mm) 0.250.320.30.250.25
Phase thickness (μm) 0.250.50.250.250.25
Tstart (C) 40.40.35.45.40.
Tend (C) 120.200.240.230.210.
Heat rate (K/min) 5.4.8.3.5.
Initial hold (min) 5.5.2.51. 
Final hold (min) 3. 2.10. 
I 1309.1313.1295.1291.1301.
ReferenceLópez, Guzmán, et al., 2004López, Ortín, et al., 2003Triqui and Bouchriti, 2003Darriet, Pons, et al., 2002Kumazawa and Masuda, 2002
Comment MSDC-RI MSDC-RI MSDC-RI MSDC-RI MSDC-RI
Column type CapillaryCapillaryCapillaryCapillaryCapillary
Active phase DB-WaxDB-WaxDB-FFAPEC-1000DB-Wax
Column length (m) 60.30.30.30.30.
Carrier gas HeHeHeHeHe
Substrate      
Column diameter (mm) 0.250.320.320.250.53
Phase thickness (μm) 0.250.50.250.251.
Tstart (C) 40.40.40.35.40.
Tend (C) 210.240.230.230.225.
Heat rate (K/min) 5.7.6.5.6.
Initial hold (min)   2.5.5.
Final hold (min)  5.5.15.30.
I 1302.1309.1290.1300.1291.
ReferenceKumazawa and Masuda, 2002Lin, Rouseff, et al., 2002Sanz, Czerny, et al., 2002Bendall, 2001Cadwallader and Heo, 2001
Comment MSDC-RI MSDC-RI MSDC-RI MSDC-RI MSDC-RI
Column type CapillaryCapillaryCapillaryCapillaryCapillary
Active phase HP-FFAPDB-FFAPFFAPSupelcowax-10DB-Wax
Column length (m) 50.30.30.60.60.
Carrier gas  HeHeHe 
Substrate      
Column diameter (mm) 0.320.320.320.250.32
Phase thickness (μm) 0.50.250.250.25 
Tstart (C) 35.40.40.35.30.
Tend (C) 230.195.230.200.170.
Heat rate (K/min) 6.5.6.4.2.
Initial hold (min)  5.2.10.4.
Final hold (min) 15.40.5. 60.
I 1305.1285.1296.1333.1297.
ReferencePreininger and Ullrich, 2001Suriyaphan, Drake, et al., 2001Czerny and Grosch, 2000Girard and Durance, 2000Buttery, Orts, et al., 1999
Comment MSDC-RI MSDC-RI MSDC-RI MSDC-RI MSDC-RI
Column type CapillaryCapillaryCapillaryCapillaryCapillary
Active phase DB-WaxDB-WaxDB-WaxDB-WaxDB-Wax
Column length (m) 30.30.30.60.60.
Carrier gas     He
Substrate      
Column diameter (mm) 0.530.530.530.250.25
Phase thickness (μm)   1.0.250.25
Tstart (C) 60.60.40.40.60.
Tend (C) 210.210.210.210.240.
Heat rate (K/min) 4.4.5.5.4.
Initial hold (min)      
Final hold (min)      
I 1315.1312.1309.1307.1310.
ReferenceIwatsuki, Mizota, et al., 1999Iwatsuki, Mizota, et al., 1999Kumazawa and Masuda, 1999Kumazawa and Masuda, 1999Ngassoum, Yonkeu, et al., 1999
Comment MSDC-RI MSDC-RI MSDC-RI MSDC-RI MSDC-RI
Column type CapillaryCapillaryCapillaryCapillaryCapillary
Active phase DB-WaxDB-WaxDB-WaxDB-WaxDB-Wax
Column length (m) 60.60.30.60.30.
Carrier gas HeHeHelium Hydrogen
Substrate      
Column diameter (mm) 0.320.320.330.250.32
Phase thickness (μm) 0.50.250.25 0.50
Tstart (C) 34.34.40.30.35.
Tend (C) 200.200.200.170.250.
Heat rate (K/min) 5.5.6.2.4.
Initial hold (min) 3.3.5.4.0.5
Final hold (min) 10.10.30.30. 
I 1325.1279.1298.1297.1312.
ReferenceSchlüter, Steinhart, et al., 1999Schlüter, Steinhart, et al., 1999Suriyaphan, Drake, et al., 1999Buttery and Ling, 1998Farkas, Sádecká, et al., 1997
Comment MSDC-RI MSDC-RI MSDC-RI MSDC-RI MSDC-RI
Column type CapillaryCapillaryCapillaryPackedCapillary
Active phase Carbowax 20MDB-WaxDB-WaxCarbowaxCarbowax 20M
Column length (m) 15.30.60.3.150.
Carrier gas   HeHeHe
Substrate    Chromosorb G AW DMCS 
Column diameter (mm) 0.320.250.25 0.64
Phase thickness (μm)  0.25   
Tstart (C) 50.20.60.60.50.
Tend (C) 225.230.180.180.170.
Heat rate (K/min) 6.5.2.4.1.
Initial hold (min) 3.1.4. 10.
Final hold (min)     60.
I 1304.1284.1290.1290.1290.
ReferenceRoberts and Acree, 1996Christensen and Reineccius, 1995Kobayashi, Tsuda, et al., 1995Schieberle and Grosch, 1983Seifert and King, 1982
Comment MSDC-RI MSDC-RI MSDC-RI MSDC-RI MSDC-RI
Column type Capillary
Active phase Carbowax 20M
Column length (m) 150.
Carrier gas  
Substrate  
Column diameter (mm) 0.64
Phase thickness (μm)  
Tstart (C) 50.
Tend (C) 170.
Heat rate (K/min) 1.
Initial hold (min) 30.
Final hold (min)  
I 1290.
ReferenceButtery and Kamm, 1980
Comment MSDC-RI

References

Go To: Top, Normal alkane RI, 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.

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Kobayashi, Tsuda, et al., 1995
Kobayashi, A.; Tsuda, Y.; Hirata, N.; Kubota, K.; Kitamura, K., Aroma constituents of soybean [Glycine max (L.) Merril] milk lacking lipoxygenase isozymes, J. Agric. Food Chem., 1995, 43, 9, 2449-2452, https://doi.org/10.1021/jf00057a025 . [all data]

Schieberle and Grosch, 1983
Schieberle, P.; Grosch, W., Identifizierung von Aromastoffen aus der Kruste von Roggenbrot, Z. Lebensm. Unters. Forsch., 1983, 177, 3, 173-180, https://doi.org/10.1007/BF01146791 . [all data]

Seifert and King, 1982
Seifert, R.M.; King, A.D., Jr., Identification of some volatile constituents of Aspergillus clavatus, J. Agric. Food Chem., 1982, 30, 4, 786-790, https://doi.org/10.1021/jf00112a044 . [all data]

Buttery and Kamm, 1980
Buttery, R.G.; Kamm, J.A., Volatile components of alfalfa: possible insect host plant attractants, J. Agric. Food Chem., 1980, 28, 5, 978-981, https://doi.org/10.1021/jf60231a014 . [all data]


Notes

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