Furfural
- Formula: C5H4O2
- Molecular weight: 96.0841
- IUPAC Standard InChIKey: HYBBIBNJHNGZAN-UHFFFAOYSA-N
- CAS Registry Number: 98-01-1
- Chemical structure:
This structure is also available as a 2d Mol file or as a computed 3d SD file
The 3d structure may be viewed using Java or Javascript. - Species with the same structure:
- Other names: 2-Furancarboxaldehyde; 2-Furaldehyde; α-Furole; Artificial ant oil; Fural; Furaldehyde; Furale; Furancarbonal; Furfuraldehyde; Furfurole; Furfurylaldehyde; Furole; Pyromucic aldehyde; 2-Formylfuran; 2-Furanaldehyde; 2-Furancarbonal; 2-Furfural; 2-Furfuraldehyde; 2-Furylaldehyde; Furol; 2-Furylmethanal; Artificial oil of ants; Furfurale; Furfurol; NCI-C56177; 2-Furil-metanale; 2-Furankarbaldehyd; Rcra waste number U125; 2-Furylcarboxaldehyde; Qo furfural; Furan-2-aldehyde; Furan-2-carbaldehyde; NSC 8841; 2-furancarboxyaldehyde; furfural (2-furancarboxaldehyde); 2-Furancarboxaldehyde (furfural); furancarboxaldehyde (furfural)
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Van Den Dool and Kratz 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 | Capillary | Capillary | Capillary | Capillary | Capillary |
---|---|---|---|---|---|
Active phase | DB-Wax | DB-Wax | HP-Innowax | DB-Wax | DB-Wax |
Column length (m) | 30. | 30. | 60. | 60. | 60. |
Carrier gas | He | He | He | He | He |
Substrate | |||||
Column diameter (mm) | 0.25 | 0.25 | 0.25 | 0.25 | 0.25 |
Phase thickness (μm) | 0.5 | 0.5 | 0.25 | 0.25 | 0.25 |
Tstart (C) | 40. | 40. | 50. | 40. | 40. |
Tend (C) | 250. | 250. | 220. | 200. | 265. |
Heat rate (K/min) | 4. | 4. | 4. | 4. | 7. |
Initial hold (min) | 5. | 5. | 4. | 1. | |
Final hold (min) | 15. | 15. | 10. | 10. | 5. |
I | 1460. | 1464. | 1439. | 1465. | 1480. |
Reference | Pozo-Bayon M.A., Ruiz-Rodriguez A., et al., 2007 | Pozo-Bayon M.A., Ruiz-Rodriguez A., et al., 2007 | Quijano, Linares, et al., 2007 | Cho, Choi, et al., 2006 | Gurbuz O., Rouseff J.M., et al., 2006 |
Comment | MSDC-RI | MSDC-RI | MSDC-RI | MSDC-RI | MSDC-RI |
Column type | Capillary | Capillary | Capillary | Capillary | Capillary |
---|---|---|---|---|---|
Active phase | DB-Wax | ZB-Wax | Innowax | DB-Wax | CP-Wax 52CB |
Column length (m) | 30. | 30. | 60. | 30. | 50. |
Carrier gas | He | He | He | He | |
Substrate | |||||
Column diameter (mm) | 0.32 | 0.25 | 0.25 | 0.32 | 0.32 |
Phase thickness (μm) | 0.5 | 0.15 | 0.25 | 0.5 | |
Tstart (C) | 40. | 35. | 40. | 40. | 60. |
Tend (C) | 265. | 220. | 230. | 240. | 220. |
Heat rate (K/min) | 7. | 5. | 4. | 5. | 4. |
Initial hold (min) | 5. | 4. | 5. | ||
Final hold (min) | 5. | 10. | 20. | 10. | 30. |
I | 1476. | 1462. | 1458. | 1469. | 1456. |
Reference | Gurbuz O., Rouseff J.M., et al., 2006 | Ledauphin, Basset, et al., 2006 | Lee, Lee, et al., 2006 | Lopez-Galilea I., Fournier N., et al., 2006 | Mahadevan and Farmer, 2006 |
Comment | MSDC-RI | MSDC-RI | MSDC-RI | MSDC-RI | MSDC-RI |
Column type | Capillary | Capillary | Capillary | Capillary | Capillary |
---|---|---|---|---|---|
Active phase | CP-Wax 52CB | CP-Wax 52CB | DB-Wax | DB-Wax | OV-351 |
Column length (m) | 50. | 50. | 60. | 30. | 50. |
Carrier gas | H2 | He | He | ||
Substrate | |||||
Column diameter (mm) | 0.32 | 0.32 | 0.25 | 0.25 | 0.32 |
Phase thickness (μm) | 0.25 | 0.25 | 0.2 | ||
Tstart (C) | 60. | 60. | 30. | 40. | 60. |
Tend (C) | 220. | 220. | 230. | 250. | 220. |
Heat rate (K/min) | 4. | 4. | 3. | 3. | 5. |
Initial hold (min) | 5. | 5. | 2. | ||
Final hold (min) | 30. | 30. | 4. | 20. | |
I | 1458. | 1468. | 1462. | 1432. | 1445. |
Reference | Mahadevan and Farmer, 2006 | Mahadevan and Farmer, 2006 | Schwambach and Peterson, 2006 | Berlinet, Ducruet, et al., 2005 | Bonvehí, 2005 |
Comment | MSDC-RI | MSDC-RI | MSDC-RI | MSDC-RI | MSDC-RI |
Column type | Capillary | Capillary | Capillary | Capillary | Capillary |
---|---|---|---|---|---|
Active phase | DB-FFAP | Stabilwax | Innowax | Innowax | Supelcowax-10 |
Column length (m) | 30. | 30. | 50. | 30. | 30. |
Carrier gas | N2 | N2 | He | He | He |
Substrate | |||||
Column diameter (mm) | 0.25 | 0.32 | 0.25 | 0.25 | 0.25 |
Phase thickness (μm) | 0.25 | 1. | 0.25 | 0.25 | 0.25 |
Tstart (C) | 40. | 40. | 50. | 40. | 60. |
Tend (C) | 230. | 230. | 220. | 200. | 240. |
Heat rate (K/min) | 5. | 4. | 2. | 5. | 3. |
Initial hold (min) | 2. | 2. | 3. | 5. | 5. |
Final hold (min) | 6. | 10. | 20. | 2. | 10. |
I | 1455. | 1474. | 1471. | 1471. | 1454. |
Reference | Colahan-Sederstrom and Peterson, 2005 | Fang and Qian, 2005 | Lee, Lee, et al., 2005 | Pena, Barciela, et al., 2005 | Riu-Aumatell, Lopez-Tamames, et al., 2005 |
Comment | MSDC-RI | MSDC-RI | MSDC-RI | MSDC-RI | MSDC-RI |
Column type | Capillary | Capillary | Capillary | Capillary | Capillary |
---|---|---|---|---|---|
Active phase | Carbowax 20M | ZB-Wax | DB-Wax | OV-351 | AT-Wax |
Column length (m) | 60. | 30. | 30. | 50. | 60. |
Carrier gas | He | He | He | He | He |
Substrate | |||||
Column diameter (mm) | 0.25 | 0.25 | 0.25 | 0.32 | 0.32 |
Phase thickness (μm) | 0.25 | 0.15 | 0.25 | 0.2 | 0.25 |
Tstart (C) | 45. | 35. | 40. | 60. | 65. |
Tend (C) | 250. | 220. | 240. | 220. | 250. |
Heat rate (K/min) | 2. | 1.8 | 6. | 5. | 2. |
Initial hold (min) | 0.17 | 10. | 10. | 10. | |
Final hold (min) | 10. | 25. | 60. | ||
I | 1447. | 1462. | 1439. | 1438. | 1451. |
Reference | Verzera, Campisi, et al., 2005 | Ledauphin, Saint-Clair, et al., 2004 | Varming, Andersen, et al., 2004 | Bonvehi and Coll, 2003 | Pino, Almora, et al., 2003 |
Comment | MSDC-RI | MSDC-RI | MSDC-RI | MSDC-RI | MSDC-RI |
Column type | Capillary | Capillary | Capillary | Capillary | Capillary |
---|---|---|---|---|---|
Active phase | Supelcowax-10 | Supelcowax-10 | AT-Wax | Supelcowax-10 | CP-Wax 52CB |
Column length (m) | 60. | 30. | 60. | 60. | 50. |
Carrier gas | He | He | He | He | H2 |
Substrate | |||||
Column diameter (mm) | 0.25 | 0.25 | 0.32 | 0.25 | 0.32 |
Phase thickness (μm) | 0.25 | 0.25 | 0.25 | 0.25 | |
Tstart (C) | 35. | 50. | 65. | 35. | 50. |
Tend (C) | 195. | 230. | 250. | 195. | 200. |
Heat rate (K/min) | 2. | 3. | 2. | 2. | 2. |
Initial hold (min) | 5. | 10. | 5. | ||
Final hold (min) | 90. | 30. | 60. | 90. | |
I | 1471. | 1456. | 1448. | 1471. | 1449. |
Reference | Chung, Yung, et al., 2002 | Moreira, Trugo, et al., 2002 | Pino, Marbot, et al., 2002 | Chung, Yung, et al., 2001 | Liu, Yang, et al., 2001 |
Comment | MSDC-RI | MSDC-RI | MSDC-RI | MSDC-RI | MSDC-RI |
Column type | Capillary | Capillary | Capillary | Capillary | Capillary |
---|---|---|---|---|---|
Active phase | AT-Wax | AT-Wax | CP-Wax 52CB | DB-FFAP | Supelcowax-10 |
Column length (m) | 60. | 60. | 60. | 30. | 60. |
Carrier gas | He | He | He | H2 | He |
Substrate | |||||
Column diameter (mm) | 0.32 | 0.32 | 0.25 | 0.32 | 0.25 |
Phase thickness (μm) | 0.25 | 0.25 | 0.25 | 0.25 | 0.25 |
Tstart (C) | 65. | 65. | 45. | 40. | 35. |
Tend (C) | 250. | 250. | 250. | 240. | 195. |
Heat rate (K/min) | 2. | 2. | 2. | 5. | 2. |
Initial hold (min) | 10. | 10. | 0.17 | 2. | |
Final hold (min) | 60. | 60. | 90. | ||
I | 1452. | 1448. | 1447. | 1460. | 1472. |
Reference | Pino and Marbot, 2001 | Pino, Marbot, et al., 2001 | Verzera, Campisi, et al., 2001 | Charles, Martin, et al., 2000 | Chung, 2000 |
Comment | MSDC-RI | MSDC-RI | MSDC-RI | MSDC-RI | MSDC-RI |
Column type | Capillary | Capillary | Capillary | Capillary | Capillary |
---|---|---|---|---|---|
Active phase | CP-Wax 52CB | CP-Wax 52CB | CP-Wax 52CB | Supelcowax-10 | Supelcowax-10 |
Column length (m) | 50. | 50. | 50. | 60. | 60. |
Carrier gas | He | He | |||
Substrate | |||||
Column diameter (mm) | 0.32 | 0.32 | 0.32 | 0.25 | 0.25 |
Phase thickness (μm) | 0.25 | 0.25 | |||
Tstart (C) | 60. | 60. | 40. | 35. | 35. |
Tend (C) | 220. | 220. | 220. | 195. | 195. |
Heat rate (K/min) | 4. | 4. | 4. | 2. | 2. |
Initial hold (min) | 5. | 5. | 5. | 5. | 5. |
Final hold (min) | 30. | 30. | 30. | 90. | 90. |
I | 1460. | 1455. | 1462. | 1473. | 1472. |
Reference | Chevance and Farmer, 1999 | Chevance and Farmer, 1999, 2 | Chevance and Farmer, 1999, 2 | Chung, 1999 | Chung, 1999, 2 |
Comment | MSDC-RI | MSDC-RI | MSDC-RI | MSDC-RI | MSDC-RI |
Column type | Capillary | Capillary | Capillary | Capillary | Capillary |
---|---|---|---|---|---|
Active phase | DB-Wax | FFAP | PEG-20M | DB-Wax | DB-Wax |
Column length (m) | 60. | 30. | 60. | 60. | 60. |
Carrier gas | He | He | He | He | |
Substrate | |||||
Column diameter (mm) | 0.25 | 0.25 | 0.25 | 0.25 | 0.25 |
Phase thickness (μm) | 0.25 | 0.25 | 0.25 | 0.25 | 0.25 |
Tstart (C) | 40. | 20. | 50. | 50. | 50. |
Tend (C) | 200. | 200. | 230. | 230. | 230. |
Heat rate (K/min) | 3. | 4. | 2. | 2. | 3. |
Initial hold (min) | 5. | 1. | |||
Final hold (min) | 60. | 1. | 60. | 60. | |
I | 1458. | 1495. | 1456. | 1456. | 1467. |
Reference | Cha, Kim, et al., 1998 | Ott, Fay, et al., 1997 | Shimoda, Nakada, et al., 1997 | Shimoda, Shiratsuchi, et al., 1996 | Shimoda, Wu, et al., 1996 |
Comment | MSDC-RI | MSDC-RI | MSDC-RI | MSDC-RI | MSDC-RI |
Column type | Capillary | Capillary | Capillary | Capillary | Capillary |
---|---|---|---|---|---|
Active phase | DB-Wax | DB-Wax | DB-Wax | DB-Wax | DB-Wax |
Column length (m) | 60. | 60. | 60. | 60. | 30. |
Carrier gas | He | He | He | ||
Substrate | |||||
Column diameter (mm) | 0.25 | 0.25 | 0.25 | 0.25 | 0.25 |
Phase thickness (μm) | 0.25 | 0.25 | 0.25 | ||
Tstart (C) | 50. | 50. | 40. | 50. | 40. |
Tend (C) | 230. | 230. | 200. | 230. | 200. |
Heat rate (K/min) | 2. | 2. | 3. | 2. | 2. |
Initial hold (min) | 5. | 4. | 10. | ||
Final hold (min) | 60. | 30. | |||
I | 1447. | 1465. | 1466. | 1457. | 1451. |
Reference | Shimoda, Shigematsu, et al., 1995 | Shiratsuchi, Shimoda, et al., 1994 | Sumitani, Suekane, et al., 1994 | Shiratsuchi, Shimoda, et al., 1993 | Umano, Hagi, et al., 1992 |
Comment | MSDC-RI | MSDC-RI | MSDC-RI | MSDC-RI | MSDC-RI |
Column type | Capillary | Capillary | Capillary | Capillary | Capillary |
---|---|---|---|---|---|
Active phase | Supelcowax-10 | Supelcowax-10 | CP-WAX 57CB | CP-WAX 57CB | CP-WAX 57CB |
Column length (m) | 60. | 60. | 50. | 50. | 50. |
Carrier gas | He | He | |||
Substrate | |||||
Column diameter (mm) | 0.25 | 0.25 | 0.24 | 0.32 | 0.32 |
Phase thickness (μm) | 0.25 | 0.25 | |||
Tstart (C) | 40. | 40. | 50. | 60. | 60. |
Tend (C) | 175. | 175. | 210. | 200. | 200. |
Heat rate (K/min) | 2. | 2. | 2. | 4. | 4. |
Initial hold (min) | 5. | 5. | 5. | 5. | 5. |
Final hold (min) | 20. | 20. | 10. | ||
I | 1469. | 1471. | 1445. | 1455. | 1454. |
Reference | Tanchotikul and Hsieh, 1989 | Tanchotikul and Hsieh, 1989 | Baltes and Mevissen, 1988 | Salter L.J., Mottram D.S., et al., 1988 | Whitfield, Mottram, et al., 1988 |
Comment | MSDC-RI | MSDC-RI | MSDC-RI | MSDC-RI | MSDC-RI |
Column type | Capillary | Capillary | Capillary |
---|---|---|---|
Active phase | CP-WAX 57CB | Carbowax 20M | Carbowax 20M |
Column length (m) | 50. | 50. | 50. |
Carrier gas | He | He | H2 |
Substrate | |||
Column diameter (mm) | 0.32 | 0.32 | 0.2 |
Phase thickness (μm) | |||
Tstart (C) | 60. | 50. | 50. |
Tend (C) | 200. | 200. | 200. |
Heat rate (K/min) | 4. | 2. | 2. |
Initial hold (min) | 5. | 5. | |
Final hold (min) | 10. | 40. | 55. |
I | 1455. | 1460. | 1429. |
Reference | Whitfield, Mottram, et al., 1988 | Chen, Kuo, et al., 1986 | Wu and Liou, 1986 |
Comment | MSDC-RI | MSDC-RI | MSDC-RI |
References
Go To: Top, Van Den Dool and Kratz 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.
Pozo-Bayon M.A., Ruiz-Rodriguez A., et al., 2007
Pozo-Bayon M.A.; Ruiz-Rodriguez A.; Pernin K.; Cayot N.,
Influence of eggs on the aroma composition of a sponge cake and on the aroma release in model studies on flavored sponge cakes,
J. Agric. Food Chem., 2007, 55, 4, 1418-1426, https://doi.org/10.1021/jf062203y
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Quijano, Linares, et al., 2007
Quijano, C.E.; Linares, D.; Pino, J.A.,
Changes in volatile compounds of fermented cereza agria [Phyllanthus acidus (L.) Skeels] fruit,
Flavour Fragr. J., 2007, 22, 5, 392-394, https://doi.org/10.1002/ffj.1810
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Cho, Choi, et al., 2006
Cho, I.H.; Choi, H.-K.; Kim, Y.-S.,
Difference in the volatile composition of pine-mushrooms (Tricholoma matsutake Sing.) according to their grades,
J. Agric. Food Chem., 2006, 54, 13, 4820-4825, https://doi.org/10.1021/jf0601416
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Gurbuz O., Rouseff J.M., et al., 2006
Gurbuz O.; Rouseff J.M.; Rouseff R.L.,
Comparison of aroma volatiles in commercial Merlot and Cabernet Sauvignon wines using gas chromatography - Olfactometry and gas chromatography - Mass spectrometry,
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Ledauphin, Basset, et al., 2006
Ledauphin, J.; Basset, B.; Cohen, S.; Payot, T.; Barillier, D.,
Identification of trace volatile compounds in freshly distilled Calvados and Cognac: Carbonyl and sulphur compounds,
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Development of Korean red wines using Vitis labrusca varieties: instrumental and sensory characterization,
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Changes in headspace volatile concentrations of coffee brews caused by the roasting process and the brewing procedure,
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Mahadevan and Farmer, 2006
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Key Odor Impact Compounds in Three Yeast Extract Pastes,
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Schwambach and Peterson, 2006
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Reduction of Stale Flavor Development in Low-Heat Skim Milk Powder via Epicatechin Addition,
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Berlinet, Ducruet, et al., 2005
Berlinet, C.; Ducruet, V.; Brillouet, J.-M.; Reynes, M.; Brat, P.,
Evolution of aroma compounds from orange juice stored in polyethylene terephthalate (PET),
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Bonvehí, 2005
Bonvehí, J.S.,
Investigation of aromatic compounds in roasted cocoa powder,
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Colahan-Sederstrom and Peterson, 2005
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Fang and Qian, 2005
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Pena, Barciela, et al., 2005
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Optimization of solid-phase microextraction methods for GC-MS determination of terpenes in wine,
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Riu-Aumatell, Lopez-Tamames, et al., 2005
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Assessment of the Volatile Composition of Juices of Apricot, Peach, and Pear According to Two Pectolytic Treatments,
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Verzera, Campisi, et al., 2005
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Ledauphin, Saint-Clair, et al., 2004
Ledauphin, J.; Saint-Clair, J.-F.; Lablanquie, O.; Guichard, H.; Founier, N.; Guichard, E.; Barillier, D.,
Identification of trace volatile compounds in freshly distilled calvados and cognac using preparative separations coupled with gas chromatography-mass spectrometry,
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Varming, Andersen, et al., 2004
Varming, C.; Andersen, M.L.; Poll, L.,
Influence of thermal treatment on black currant (Ribes nigrum L.) juice aroma,
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Bonvehi and Coll, 2003
Bonvehi, J.S.; Coll, F.V.,
Flavour index and aroma profiles of fresh and processed honeys,
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Pino, Almora, et al., 2003
Pino, J.; Almora, K.; Marbot, R.,
Volatile components of papaya (Carica papaya L., maradol variety) fruit,
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Chung, Yung, et al., 2002
Chung, H.-Y.; Yung, I.K.S.; Ma, W.C.J.; Kim, J.-S.,
Analysis of volatile components in frozen and dried scallops (Patinopecten yessoensis) by gas chromatography/mass spectrometry,
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Moreira, Trugo, et al., 2002
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Flavor composition of cashew (Anacardium occidentale) and marmeleiro (Croton species) honeys,
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Pino, Marbot, et al., 2002
Pino, J.A.; Marbot, R.; Vázquez, C.,
Characterization of volatile in Cosa Rican Guava [Psidium friedrichsthalianum (Berg) Niedenzu] fruit,
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Chung, Yung, et al., 2001
Chung, H.Y.; Yung, I.K.S.; Kim, J.-S.,
Comparison of volatile components in dried scallops (Chlamys farreri and Patinopecten yessoensis) prepared by boiling and steaming methods,
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Liu, Yang, et al., 2001
Liu, T.-T.; Yang, T.-S.; Wu, C.-M.,
Changes of volatiles in soy sauce-stewed pork during cold storage and reheating,
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Pino and Marbot, 2001
Pino, J.A.; Marbot, R.,
Volatile flavor constituents of acerola (Malpighia emarginata DC.) fruit,
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Pino, Marbot, et al., 2001
Pino, J.A.; Marbot, R.; Vázquez, C.,
Characterization of volatiles in strawberry guava (Psidium cattleianum Sabine) fruit,
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Verzera, Campisi, et al., 2001
Verzera, A.; Campisi, S.; Zappalá, M.; Bonaccorsi, I.,
SPME-GC-MS analysis of honey volatile components for the characterization of different floral origin,
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Notes
Go To: Top, Van Den Dool and Kratz RI, polar column, temperature ramp, References
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