Azulene, 1,2,3,3a,4,5,6,7-octahydro-1,4-dimethyl-7-(1-methylethenyl)-, [1R-(1α,3aβ,4α,7β)]-


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 CapillaryCapillaryCapillaryCapillaryCapillary
Active phase DB-5HP-5HP-5 MSDB-5HP-5 MS
Column length (m) 30.30.30.30.30.
Carrier gas HeliumHeliumHeliumNitrogenHelium
Substrate      
Column diameter (mm) 0.250.250.250.250.25
Phase thickness (μm) 0.250.250.250.250.25
Tstart (C) 50.50.100.40.70.
Tend (C) 250.240.220.230.210.
Heat rate (K/min) 2.3.2.2.5.
Initial hold (min)  5.  1.
Final hold (min)     5.
I 1477.1459.1471.1477.1479.
ReferenceHo, Wang, et al., 2010Monsef-Esfahani, Miri, et al., 2010Pripdeevech, Chumpolsri, et al., 2010Scrivanti, Anton, et al., 2009Bouwmeester, de Kraker, et al., 2008
Comment MSDC-RI MSDC-RI MSDC-RI MSDC-RI MSDC-RI
Column type CapillaryCapillaryCapillaryCapillaryCapillary
Active phase HP-5DB-5 MSHP-5Col-Elite 5MSHP-1
Column length (m) 30.30.30.30.30.
Carrier gas HeliumHeliumHeliumHeHe
Substrate      
Column diameter (mm) 0.320.250.250.250.25
Phase thickness (μm) 0.250.250.320.250.25
Tstart (C) 100.50.60.30.60.
Tend (C) 240.300.250.246.240.
Heat rate (K/min) 5.5.5.3.2.
Initial hold (min) 2.5.30.  
Final hold (min) 5.5.  20.
I 1473.1468.1473.1487.1468.
ReferenceLago, Romoff, et al., 2008Noudogbessi, Yedomonhan, et al., 2008Yassa and Akhani, 2008Gudaityte and Venskutonis R.P., 2007Hachicha, Skanji, et al., 2007
Comment MSDC-RI MSDC-RI MSDC-RI MSDC-RI MSDC-RI
Column type CapillaryCapillaryCapillaryCapillaryCapillary
Active phase HP-5 MSHP-5HP-5MSHP-5HP-5MS
Column length (m) 60.30.30.25.30.
Carrier gas HydrogenHeHeHe 
Substrate      
Column diameter (mm) 0.250.250.250.250.25
Phase thickness (μm) 0.250.320.250.250.25
Tstart (C) 60.60.40.50.60.
Tend (C) 260.250.260.300.280.
Heat rate (K/min) 4.5.4.5.4.
Initial hold (min)  30. 5. 
Final hold (min) 20.    
I 1475.1473.1472.21472.1471.
ReferenceRojas, Velasco, et al., 2007Yassa and Akhani, 2007Zizovic, Stamenic, et al., 2007Champagnat, Figueredo, et al., 2006Ebrahim Sajjadi and Mehregan, 2006
Comment MSDC-RI MSDC-RI MSDC-RI MSDC-RI MSDC-RI
Column type CapillaryCapillaryCapillaryCapillaryCapillary
Active phase DB-5CP Sil 5 CBCP Sil 5 CBDB-5DB-5
Column length (m) 30.30.30.30.30.
Carrier gas He N2HeHe
Substrate      
Column diameter (mm) 0.250.250.250.250.25
Phase thickness (μm) 0.250.250.250.250.25
Tstart (C) 50.40.50.60.60.
Tend (C) 250.220.200.220.210.
Heat rate (K/min) 3.3.5.4.3.
Initial hold (min)     5.
Final hold (min) 10.3.   
I 1473.1477.1468.1478.1471.
ReferenceHavlik, Kokoska, et al., 2006Hymete, Rohloff, et al., 2006Martin, Joseph, et al., 2006Morteza-Semnani, Akbarzadeh, et al., 2006Askari and Sefidkon, 2005
Comment MSDC-RI MSDC-RI MSDC-RI MSDC-RI MSDC-RI
Column type CapillaryCapillaryCapillaryCapillaryCapillary
Active phase HP-5CP Sil 5 CBDB-1DB-5CP Sil 5 CB
Column length (m) 30.30.60.30.25.
Carrier gas HeN2HeHe 
Substrate      
Column diameter (mm) 0.250.250.250.250.25
Phase thickness (μm) 0.250.250.250.250.15
Tstart (C) 50.60.50.60.50.
Tend (C) 300.250.250.220.230.
Heat rate (K/min) 5.5.4.4.3.
Initial hold (min) 5. 5.4. 
Final hold (min) 5.10.   
I 1459.1484.1472.1479.1471.
ReferenceFiguérédo, Cabassu, et al., 2005Jassbi, Mehrdad, et al., 2005Khajeh, Yamini, et al., 2005Morteza-Semnani and Saeedi, 2005Ogunwande, Olawore, et al., 2005
Comment MSDC-RI MSDC-RI MSDC-RI MSDC-RI MSDC-RI
Column type CapillaryCapillaryCapillaryCapillaryCapillary
Active phase DB-1DB-5DB-5RTX-1DB-1
Column length (m) 50.30.30.60.60.
Carrier gas N2HeHeHeHe
Substrate      
Column diameter (mm) 0.250.250.250.250.25
Phase thickness (μm) 0.250.250.250.250.25
Tstart (C) 95.60.60.60.60.
Tend (C) 240.300.300.25.250.
Heat rate (K/min) 4.3.3.5.5.
Initial hold (min)      
Final hold (min)    10.10.
I 1463.1470.1470.1454.1446.
ReferencePala-Paul, Perez-Alonso, et al., 2005Simoes-Pires C.A., Debenedetti S., et al., 2005Simoes-Pires C.A., Debenedetti S., et al., 2005Sonboli, Salehi, et al., 2005Sonboli, Salehi, et al., 2005, 2
Comment MSDC-RI MSDC-RI MSDC-RI MSDC-RI MSDC-RI
Column type CapillaryCapillaryCapillaryCapillaryCapillary
Active phase HP-5 MSZB-5RTX-1DB-5MSHP-5MS
Column length (m) 30.60.30.30.30.
Carrier gas HeHeN2HeHe
Substrate      
Column diameter (mm) 0.250.250.250.250.25
Phase thickness (μm) 0.500.250.250.250.25
Tstart (C) 60.40.60.60.60.
Tend (C) 260.260.300.280.275.
Heat rate (K/min) 3.6.4.3.4.
Initial hold (min)  4.6   
Final hold (min) 20.1. 30. 
I 1472.1491.1461.1454.1473.
ReferenceTopçu, Barla, et al., 2005Jürgens and Dötterl, 2004Kalemba and Thiem, 2004Marongiu, Piras, et al., 2004Afsharypuor and Jahromy, 2003
Comment MSDC-RI MSDC-RI MSDC-RI MSDC-RI MSDC-RI
Column type CapillaryCapillaryCapillaryCapillaryCapillary
Active phase DB-5DB-5HP-5DB-1DB-1
Column length (m) 50.30.30.60.60.
Carrier gas HeHeHeHeHe
Substrate      
Column diameter (mm) 0.20.250.250.250.25
Phase thickness (μm) 0.250.250.250.25 
Tstart (C) 50.60.60.50.40.
Tend (C) 220.250.280.280.250.
Heat rate (K/min) 3.3.3.4.4.
Initial hold (min) 2.    
Final hold (min) 10.    
I 1477.1470.1451.1454.1451.
ReferenceJuteau, Jerkovic, et al., 2003Limberger, Simões-Pires, et al., 2003Pitarokili, Tzakou, et al., 2003Ahmadi, Mirza, et al., 2002Sefidkon, Dabiri, et al., 2002
Comment MSDC-RI MSDC-RI MSDC-RI MSDC-RI MSDC-RI
Column type CapillaryCapillaryCapillaryCapillaryCapillary
Active phase RTX-1DB-5DB-1DB-1DB-1
Column length (m) 30.30.30.25.60.
Carrier gas N2HeHeNitrogenN2
Substrate      
Column diameter (mm) 0.250.250.20.500.25
Phase thickness (μm) 0.250.25 0.250.25
Tstart (C) 60.60.60.60.75.
Tend (C) 300.270.240.220.220.
Heat rate (K/min) 4.3.3.5.4.
Initial hold (min)     1.
Final hold (min)     8.
I 1471.1472.1475.01473.1487.
ReferenceKalemba, Marschall, et al., 2001Palmeira, Conserva, et al., 2001Santos, Moreira, et al., 2001Mallavarapu, Rao, et al., 2000Bailac, Dellacasa, et al., 1999
Comment MSDC-RI MSDC-RI MSDC-RI MSDC-RI MSDC-RI
Column type CapillaryCapillaryCapillaryCapillary
Active phase DB-5DB-5DB-1SE-54
Column length (m) 30.30. 30.
Carrier gas HeHe Hydrogen
Substrate     
Column diameter (mm) 0.250.25 0.25
Phase thickness (μm) 0.250.25 0.25
Tstart (C) 40.65.80.60.
Tend (C) 250.300.220.250.
Heat rate (K/min) 2.4.6.2.
Initial hold (min) 5.2. 5.
Final hold (min) 60.  2.
I 1471.1479.1474.1465.
ReferencePorta, Porcedda, et al., 1999Elias, Simoneit, et al., 1997Salgueiro, Vila, et al., 1997Kollmannsberger, Nitz, et al., 1992
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.

Ho, Wang, et al., 2010
Ho, C.-L.; Wang, E.I.-C.; Yu, H.-T.; Yu, H.-M.; Su, Y.-C., Composition amd antioxidant activities of essential oils of different tissues from Cryptomeria japonica D. Don, Quarterly J. Chin. Forestry, 2010, 32, 1, 63-76. [all data]

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Pripdeevech, P.; Chumpolsri, W.; Suttiarporn, P.; Wongpornchai, S., The chemical composition and antioxidant activities of Basil from Thailand using retention indices and comprehensive two-dimensional gas chromatography, J. Seb. Chem. Soc., 2010, 75, 11, 1503-1513, https://doi.org/10.2298/JSC100203125P . [all data]

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Scrivanti, L.R.; Anton, A.M.; Zygadlo, J.A., Essential oil conposition of Bothriochloa Kuntze (Poaceae) from South America and their chemotaxonomy, Biochem. Systematics Ecol., 2009, 37, 3, 206-213, https://doi.org/10.1016/j.bse.2009.03.009 . [all data]

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Gudaityte, O.; Venskutonis R.P., Chemotypes of Achillea millefolium transferred from 14 different locations in Lithuania to the controlled environment, Biochem. Syst. Ecol., 2007, 35, 9, 582-592, https://doi.org/10.1016/j.bse.2007.03.016 . [all data]

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Rojas, J.; Velasco, J.; Rojas, L.B.; Carmona, J.; Morales, A., Chemical composition and antimicrobial activity of the essential oil of Baacharis latifolia Pers. and B. prunifolia H.B.K. (Asteraceae), Natural Product Communications, 2007, 2, 12, 1245-1248. [all data]

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Juteau, Jerkovic, et al., 2003
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Limberger, Simões-Pires, et al., 2003
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Pitarokili, Tzakou, et al., 2003
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Kalemba, Marschall, et al., 2001
Kalemba, D.; Marschall, H.; Bradesi, P., Constituents of the essential oil of Solidago gigantea Ait. (giant goldenrod), Flavour Fragr. J., 2001, 16, 1, 19-26, https://doi.org/10.1002/1099-1026(200101/02)16:1<19::AID-FFJ940>3.0.CO;2-U . [all data]

Palmeira, Conserva, et al., 2001
Palmeira, S.F., Jr.; Conserva, L.M.; Andrade, E.H.A.; Guilhon, G.M.S.P., Analysis by GC-MS of the hexane extract of the aerial parts of Aristolochia acutifolia Duchtr., Flavour Fragr. J., 2001, 16, 2, 85-88, https://doi.org/10.1002/1099-1026(200103/04)16:2<85::AID-FFJ948>3.0.CO;2-2 . [all data]

Santos, Moreira, et al., 2001
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Mallavarapu, Rao, et al., 2000
Mallavarapu, G.R.; Rao, L.; Ramesh, S., Volatile constituents of the leaf and fruit oils of Murraya koenigii Spreng., L. Ess. Oil Res., 2000, 12, 6, 766-768, https://doi.org/10.1080/10412905.2000.9712211 . [all data]

Bailac, Dellacasa, et al., 1999
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Porta, Porcedda, et al., 1999
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Elias, Simoneit, et al., 1997
Elias, V.O.; Simoneit, B.R.T.; Cardoso, J.N., Analysis of volatile sesquiterpenoids in environmental and geological samples, J. Hi. Res. Chromatogr., 1997, 20, 6, 305-309, https://doi.org/10.1002/jhrc.1240200602 . [all data]

Salgueiro, Vila, et al., 1997
Salgueiro, L.R.; Vila, R.; Tomi, F.; Figueiredo, A.C.; Barroso, J.G.; Cañigueral, S.; Casanova, J.; da Cunha, A.P.; Adzet, T., Variability of essential oils of Thymus caespititius from Portugal, Phytochemistry, 1997, 45, 2, 307-311, https://doi.org/10.1016/S0031-9422(96)00872-2 . [all data]

Kollmannsberger, Nitz, et al., 1992
Kollmannsberger, H.; Nitz, S.; Drawert, F., UBer die Aromastoffzusammensetzung von Hochdruckextrakten. I. Pfeffer (Piper nigrum, Var. muntok), Z. Lebensm. Unters Forsch., 1992, 194, 6, 545-551, https://doi.org/10.1007/BF01185481 . [all data]


Notes

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