Benzeneacetaldehyde

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Normal alkane RI, 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-FFAPAT-WaxDB-WaxDB-WaxCP Wax 52 CB
Column length (m) 25.60.60.30.30.
Carrier gas HeliumHeliumHeliumHeliumHelium
Substrate      
Column diameter (mm) 0.320.250.250.250.32
Phase thickness (μm) 0.500.250.250.250.50
Tstart (C) 45.60.50.40.40.
Tend (C) 220.280.220.210.230.
Heat rate (K/min) 15.4.3.3.4.
Initial hold (min)   2. 2.
Final hold (min)   20. 15.
I 1674.1648.1606.1648.1645.
ReferenceWanakhachornkrai and Lertsiri, 9999Kiss, Csoka, et al., 2011Onishi, Inoue, et al., 2011Kumazawa, Sakai, et al., 2010Birtic, Ginies, et al., 2009
Comment MSDC-RI MSDC-RI MSDC-RI MSDC-RI MSDC-RI
Column type CapillaryCapillaryCapillaryCapillaryCapillary
Active phase DB-WaxFFAPDB-WaxDB-WaxCP-Wax
Column length (m) 30.30.30.30.60.
Carrier gas HeliumHeliumHydrogenHydrogenHelium
Substrate      
Column diameter (mm) 0.320.320.250.250.25
Phase thickness (μm) 0.250.250.250.250.25
Tstart (C) 40.40.30.30.50.
Tend (C) 230.240.230.230.230.
Heat rate (K/min) 6.6.8.8.6.
Initial hold (min) 2.2.5.5.2.
Final hold (min) 20. 10.10.15.
I 1635.1642.1632.1632.1656.
ReferenceChen, Song, et al., 2009Christlbauer and Schieberle, 2009Karlsson, Birgersson, et al., 2009Karlsson, Birgersson, et al., 2009Mo, Fan, et al., 2009
Comment MSDC-RI MSDC-RI MSDC-RI MSDC-RI MSDC-RI
Column type CapillaryCapillaryCapillaryCapillaryCapillary
Active phase StabilwaxHP-20MHP-InnowaxCarbowaxBP-20
Column length (m) 30.50.50.60.30.
Carrier gas HeliumHeliumHeliumHeHe
Substrate      
Column diameter (mm) 0.250.250.200.20.25
Phase thickness (μm) 0.500.250.200.250.25
Tstart (C) 35.70.45.60.70.
Tend (C) 225.180.190.250.220.
Heat rate (K/min) 6.4.4.2.4.
Initial hold (min) 5.4.2.8.4.
Final hold (min) 10. 50.15.5.
I 1653.1591.1662.1593.1649.
ReferenceWatcharananun, Cadwallader, et al., 2009Blazevic and Mastelic, 2008Soria, Sanz, et al., 2008Ferhat, Tigrine-Kordjani, et al., 2007Rawat, Gulati, et al., 2007
Comment MSDC-RI MSDC-RI MSDC-RI MSDC-RI MSDC-RI
Column type CapillaryCapillaryCapillaryCapillaryCapillary
Active phase DB-WaxDB-WaxDB-Wax EtrHP-InnowaxDB-Wax Etr
Column length (m) 30.30.60.30.30.
Carrier gas HeN2HeHeHe
Substrate      
Column diameter (mm) 0.320.320.250.250.25
Phase thickness (μm) 0.250.250.250.50.25
Tstart (C) 40.40.40.40.40.
Tend (C) 230.230.230.200.220.
Heat rate (K/min) 4.6.2.2.2.
Initial hold (min) 2.2.5.3.1.
Final hold (min) 15.15.100.15.10.
I 1620.1642.1659.1635.1674.
ReferenceFan and Qian, 2006Fan and Qian, 2006, 2Ibarz, Ferreira, et al., 2006Komes, Ulrich, et al., 2006Perestrelo, Fernandes, et al., 2006
Comment MSDC-RI MSDC-RI MSDC-RI MSDC-RI MSDC-RI
Column type CapillaryCapillaryCapillaryCapillaryCapillary
Active phase DB-WaxDB-WaxCarbowax-PEGInnowaxCarbowax 20M
Column length (m) 30.60.60.50.50.
Carrier gas  HeliumHeliumHeHelium
Substrate      
Column diameter (mm) 0.250.250.200.20.25
Phase thickness (μm) 0.250.250.250.50.25
Tstart (C) 40.35.60.60.40.
Tend (C) 200.240.250.250.190.
Heat rate (K/min) 8.6.2.2.4.
Initial hold (min) 3.3.8. 2.
Final hold (min) 20.10.15.60.30.
I 1605.1644.1593.1626.1648.
ReferenceSchirack, Drake, et al., 2006Spadone, Matthey-Doret, et al., 2006Tigrine-Kordiani, Meklati, et al., 2006Bendimerad and Bendiab, 2005de la Fuente, Martinez-Castro, et al., 2005
Comment MSDC-RI MSDC-RI MSDC-RI MSDC-RI MSDC-RI
Column type CapillaryCapillaryCapillaryCapillaryCapillary
Active phase HP-InnowaxDB-WaxSupelcowax-10CP-Wax 52CBZB-Wax
Column length (m) 30.30.60.30.30.
Carrier gas HeHeHeHeHelium
Substrate      
Column diameter (mm) 0.250.250.530.320.32
Phase thickness (μm) 0.250.251.0.250.25
Tstart (C) 40.50.40.40.40.
Tend (C) 240.180.240.220.250.
Heat rate (K/min) 5.3.4.4.5.
Initial hold (min) 5. 2.1.2.
Final hold (min) 15.40.20. 5.
I 1635.1638.1689.1645.1614.
ReferenceIsogai, Utsunomiya, et al., 2005Lee, Umano, et al., 2005Rochat and Chaintreau, 2005Rohloff and Bones, 2005N/A
Comment MSDC-RI MSDC-RI MSDC-RI MSDC-RI MSDC-RI
Column type CapillaryCapillaryCapillaryCapillaryCapillary
Active phase ZB-WaxZB-WaxZB-WaxDB-WaxZB-Wax
Column length (m) 30.30.30.30.30.
Carrier gas HeliumHeliumHeH2He
Substrate      
Column diameter (mm) 0.320.320.320.320.32
Phase thickness (μm) 0.250.250.250.250.25
Tstart (C) 40.40.40.40.40.
Tend (C) 250.250.250.230.250.
Heat rate (K/min) 5.5.5.5.5.
Initial hold (min) 2.2.2.2.2.
Final hold (min) 5.5.10.15.10.
I 1616.1618.1616.1614.1616.
ReferenceN/AN/AWu, Krings, et al., 2005Wu, Krings, et al., 2005Wu, Krings, et al., 2005
Comment MSDC-RI MSDC-RI MSDC-RI MSDC-RI MSDC-RI
Column type CapillaryCapillaryCapillaryCapillaryCapillary
Active phase PEG-20MDB-WaxHP-InnowaxDB-WaxDB-Wax
Column length (m) 30.30.50.30.30.
Carrier gas  H2HeHeH2
Substrate      
Column diameter (mm) 0.250.320.20.250.32
Phase thickness (μm)  0.50.20.250.5
Tstart (C) 60.40.45.50.40.
Tend (C) 180.200.190.230.200.
Heat rate (K/min) 3.4.4.3.4.
Initial hold (min) 10.5.2.2.5.
Final hold (min) 30. 50.20. 
I 1651.1671.1668.1631.1661.
ReferenceYao, Guo, et al., 2005Culleré, Escudero, et al., 2004Soria, Gonzalez, et al., 2004Lin, Cai, et al., 2003López, Ortín, et al., 2003
Comment MSDC-RI MSDC-RI MSDC-RI MSDC-RI MSDC-RI
Column type CapillaryCapillaryCapillaryCapillaryCapillary
Active phase TC-WaxCarbowax 20MHP-FFAPDB-FFAPDB-Wax
Column length (m) 60.50.25.30.30.
Carrier gas HeHeHeHeHe
Substrate      
Column diameter (mm) 0.250.250.320.320.25
Phase thickness (μm)  0.250.50.250.25
Tstart (C) 80.45.45.40.40.
Tend (C) 250.190.220.230.210.
Heat rate (K/min) 4.4.15.6.5.
Initial hold (min)  2. 2. 
Final hold (min) 30.50. 10. 
I 1650.1664.1674.1624.1646.
ReferenceMiyazawa and Okuno, 2003Soria, Martinez-Castro, et al., 2003Wanakhachornkrai and Lertsiri, 2003Czerny and Schieberle, 2002Kumazawa and Masuda, 2002
Comment MSDC-RI MSDC-RI MSDC-RI MSDC-RI MSDC-RI
Column type CapillaryCapillaryCapillaryCapillaryCapillary
Active phase DB-WaxHP-FFAPHP-FFAPDB-WaxTC-Wax
Column length (m) 60.25.25.30.60.
Carrier gas He  HeHe
Substrate      
Column diameter (mm) 0.250.320.320.530.25
Phase thickness (μm) 0.250.520.521. 
Tstart (C) 40.60.60.40.80.
Tend (C) 210.240.240.225.250.
Heat rate (K/min) 5.5.5.6.4.
Initial hold (min)  1.1.5. 
Final hold (min)  5.5.30.47.
I 1646.1609.1609.1656.1656.
ReferenceKumazawa and Masuda, 2002Qian and Reineccius, 2002Qian and Reineccius, 2002Cadwallader and Heo, 2001Miyazawa, Kurose, et al., 2001
Comment MSDC-RI MSDC-RI MSDC-RI MSDC-RI MSDC-RI
Column type CapillaryCapillaryCapillaryCapillaryCapillary
Active phase DB-FFAPDB-WaxDB-WaxDB-WaxDB-Wax
Column length (m) 30.30.30.60.60.
Carrier gas HeH2H2NitrogenHe
Substrate      
Column diameter (mm) 0.320.320.320.250.25
Phase thickness (μm) 0.250.50.5 0.25
Tstart (C) 40.60.60.40.40.
Tend (C) 195.245.245.200.200.
Heat rate (K/min) 5.3.3.2.2.
Initial hold (min) 5.3.3.10.2.
Final hold (min) 40.20.20.  
I 1631.1625.1625.1653.1633.
ReferenceSuriyaphan, Drake, et al., 2001Kotseridis and Baumes, 2000Kotseridis and Baumes, 2000Tamura, Boonbumrung, et al., 2000Umano, Hagi, et al., 2000
Comment MSDC-RI MSDC-RI MSDC-RI MSDC-RI MSDC-RI
Column type CapillaryCapillaryCapillaryCapillaryCapillary
Active phase DB-WaxPEG-20MDB-WaxDB-WaxDB-Wax
Column length (m) 60.60.30.30.60.
Carrier gas  N2   
Substrate      
Column diameter (mm) 0.320.250.530.530.25
Phase thickness (μm)    1.0.25
Tstart (C) 30.70.60.40.40.
Tend (C) 170.220.210.210.210.
Heat rate (K/min) 2.3.4.5.5.
Initial hold (min) 4.    
Final hold (min) 60.    
I 1636.1666.1640.1648.1653.
ReferenceButtery, Orts, et al., 1999Hirose, Joichi, et al., 1999Iwatsuki, Mizota, et al., 1999Kumazawa and Masuda, 1999Kumazawa and Masuda, 1999
Comment MSDC-RI MSDC-RI MSDC-RI MSDC-RI MSDC-RI
Column type CapillaryCapillaryCapillaryCapillaryCapillary
Active phase CarbowaxDB-WaxDB-WaxDB-WaxSupelcowax-10
Column length (m) 50.60.30.60.30.
Carrier gas N2HeHelium He
Substrate      
Column diameter (mm) 0.20.320.330.250.25
Phase thickness (μm)  0.250.25  
Tstart (C) 80.34.40.30.60.
Tend (C) 200.200.200.170.240.
Heat rate (K/min) 1.5.6.2.4.
Initial hold (min)  3.5.4. 
Final hold (min) 20.10.30.30. 
I 1646.1621.1638.1636.1669.
ReferenceMenon, Chacko, et al., 1999Schlüter, Steinhart, et al., 1999Suriyaphan, Drake, et al., 1999Buttery and Ling, 1998Lamarque, Maestri, et al., 1998
Comment MSDC-RI MSDC-RI MSDC-RI MSDC-RI MSDC-RI
Column type CapillaryCapillaryCapillaryCapillaryCapillary
Active phase InnowaxDB-WaxCP-Wax 52CBCarbowax 20MPEG-20M
Column length (m) 30.60.50.60.50.
Carrier gas  H2He He
Substrate      
Column diameter (mm) 0.250.320.320.250.25
Phase thickness (μm) 0.250.250.25 0.15
Tstart (C) 40.60.50.60.60.
Tend (C) 240.220.210.180.180.
Heat rate (K/min) 6.3.1.52.2.
Initial hold (min) 10. 5.4.4.
Final hold (min) 25. 10.  
I 1639.1641.1605.1595.1592.
ReferencePetersen, Poll, et al., 1998Werkhoff, Güntert, et al., 1998Chyau, Lin, et al., 1997Kawakami, Ganguly, et al., 1995Togari, Kobayashi, et al., 1995
Comment MSDC-RI MSDC-RI MSDC-RI MSDC-RI MSDC-RI
Column type CapillaryCapillaryCapillaryCapillaryCapillary
Active phase PEG-20MCarbowax 20MCarbowax 20MDB-WaxDB-Wax
Column length (m) 50.50.50.60.60.
Carrier gas HeHeHe  
Substrate      
Column diameter (mm) 0.250.250.250.320.32
Phase thickness (μm) 0.15    
Tstart (C) 60.60.60.50.50.
Tend (C) 180.180.180.230.230.
Heat rate (K/min) 2.2.2.4.4.
Initial hold (min) 4.4.4.  
Final hold (min)    10.10.
I 1592.1595.1609.1636.1636.
ReferenceTogari, Kobayashi, et al., 1995Kawakami, Kobayashi, et al., 1993Kawakami and Kobayashi, 1991Binder, Benson, et al., 1990Binder, Turner, et al., 1990
Comment MSDC-RI MSDC-RI MSDC-RI MSDC-RI MSDC-RI
Column type CapillaryCapillaryCapillaryCapillaryPacked
Active phase DB-WaxDB-WaxDB-WaxCarbowax 20MCarbowax
Column length (m) 60. 60.150.3.
Carrier gas  30  He
Substrate     Chromosorb G AW DMCS
Column diameter (mm) 0.320.250.320.64 
Phase thickness (μm)      
Tstart (C) 50.30.50.50.60.
Tend (C) 230.240.230.170.180.
Heat rate (K/min) 4.50.4.1.4.
Initial hold (min)  10.0.130. 
Final hold (min) 10. 10.60. 
I 1636.1604.1631.1650.1645.
ReferenceBinder, Turner, et al., 1990, 2Pfannhauser, 1990Binder, Flath, et al., 1989Buttery, Ling, et al., 1983Schieberle and Grosch, 1983
Comment MSDC-RI MSDC-RI MSDC-RI MSDC-RI MSDC-RI
Column type CapillaryCapillaryCapillaryCapillary
Active phase Carbowax 20MCarbowax 20MCarbowax 20MCarbowax 20M
Column length (m) 150.150.150.150.
Carrier gas He   
Substrate     
Column diameter (mm) 0.640.640.640.64
Phase thickness (μm)     
Tstart (C) 50.50.50.50.
Tend (C) 170.170.170.170.
Heat rate (K/min) 1.1.1.1.
Initial hold (min) 10.30.30.30.
Final hold (min) 60.   
I 1630.1650.1650.1650.
ReferenceSeifert and King, 1982Buttery, Parker, et al., 1981Buttery and Kamm, 1980Buttery, Ling, et al., 1980
Comment MSDC-RI MSDC-RI MSDC-RI 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.

Wanakhachornkrai and Lertsiri, 9999
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Birtic, S.; Ginies, C.; Causse, M.; Renard, C.M.G.C.; Page, D., Changes in volatiles and glycosides during fruit maturartion of two contrasted tomato (Solanum lycopersicum) lines, J. Agric. Food Chem., 2009, 57, 2, 591-598, https://doi.org/10.1021/jf8023062 . [all data]

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Watcharananun, W.; Cadwallader, K.R.; Huangrak, K.; Kim, H.; Lorjaroenphon, Y., Identification of predominant odorants in Thai desserts flavored by smoking with Tian Op, a traditional Thai scented candle, J. Agric. Food Chem., 2009, 57, 3, 996-1005, https://doi.org/10.1021/jf802674c . [all data]

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Soria, Sanz, et al., 2008
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Ferhat, Tigrine-Kordjani, et al., 2007
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Fan and Qian, 2006, 2
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Lee, Umano, et al., 2005
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Rochat and Chaintreau, 2005
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Rohloff and Bones, 2005
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Wu, Krings, et al., 2005
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Yao, Guo, et al., 2005
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Culleré, Escudero, et al., 2004
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Notes

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