5-Hydroxymethylfurfural
- Formula: C6H6O3
- Molecular weight: 126.1100
- IUPAC Standard InChI: InChI=1S/C6H6O3/c7-3-5-1-2-6(4-8)9-5/h1-3,8H,4H2
- IUPAC Standard InChIKey: NOEGNKMFWQHSLB-UHFFFAOYSA-N
- CAS Registry Number: 67-47-0
- Chemical structure:
This structure is also available as a 2d Mol file - Other names: 2-Furancarboxaldehyde, 5-(hydroxymethyl)-; 2-Furaldehyde, 5-(hydroxymethyl)-; HMF; 5-(Hyddroxymethyl)furfurole; 5-(Hydroxymethyl)-2-formylfuran; 5-(Hydroxymethyl)-2-furaldehyde; 5-(Hydroxymethyl)-2-furancarbonal; 5-(Hydroxymethyl)-2-furfural; 5-(Hydroxymethyl)-2-furfuraldehyde; 5-(Hydroxymethyl)furan-2-aldehyde; 5-Hydroxymethylfuraldehyde; 5-Oxymethylfurfurole; 5-Hydroxymethylfurfuraldehyde; 5-Hydroxymethyl-2-furancarbaldehyde; Hydroxymethylfurfuraldehyde; 5-(Hydroxymethyl)-2-furancarboxaldehyde; 2-Hydroxymethyl-5-furfural; NSC 40738; Hydroxymethylfurfural; Hydroxymethylfurfuralaldehyde; 5-(Hydroxymethyl)furan-2-carbaldehyde; 5-Hydroxymethyl-2-furfural (HMF)
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Van Den Dool and Kratz 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 | Capillary | Capillary | Capillary | Capillary | Capillary |
|---|---|---|---|---|---|
| Active phase | OV-351 | DB-Wax | OV-351 | Supelcowax-10 | DB-Wax |
| Column length (m) | 50. | 30. | 50. | 30. | 30. |
| Carrier gas | He | Helium | He | He | He |
| Substrate | |||||
| Column diameter (mm) | 0.32 | 0.32 | 0.32 | 0.25 | 0.25 |
| Phase thickness (μm) | 0.2 | 0.50 | 0.2 | 0.25 | |
| Tstart (C) | 60. | 40. | 60. | 50. | 40. |
| Tend (C) | 220. | 240. | 220. | 230. | 200. |
| Heat rate (K/min) | 5. | 7. | 5. | 3. | 2. |
| Initial hold (min) | 10. | ||||
| Final hold (min) | 5. | 30. | |||
| I | 2496. | 2526. | 2496. | 2513. | 2485. |
| Reference | Bonvehí, 2005 | Bell, 2004 | Bonvehi and Coll, 2003 | Moreira, Trugo, et al., 2002 | Umano, Hagi, et al., 1992 |
| Comment | MSDC-RI | MSDC-RI | MSDC-RI | MSDC-RI | MSDC-RI |
| Column type | Capillary |
|---|---|
| Active phase | CP-WAX 57CB |
| Column length (m) | 50. |
| Carrier gas | He |
| Substrate | |
| Column diameter (mm) | 0.24 |
| Phase thickness (μm) | |
| Tstart (C) | 50. |
| Tend (C) | 210. |
| Heat rate (K/min) | 2. |
| Initial hold (min) | 5. |
| Final hold (min) | |
| I | 2532. |
| Reference | Baltes and Mevissen, 1988 |
| Comment | 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.
Bonvehí, 2005
Bonvehí, J.S.,
Investigation of aromatic compounds in roasted cocoa powder,
Eur. Food Res. Technol., 2005, 221, 1-2, 19-29, https://doi.org/10.1007/s00217-005-1147-y
. [all data]
Bell, 2004
Bell, W.A.-M.,
Examination of Aroma Volatiles Formed from Thermal Processing of Florida Reconstituted Grapefruit Juice. A Thesis presented to the graduate school of the university of Florida in partial fulfillment of the requirements for the degree of master of science, 2004. [all data]
Bonvehi and Coll, 2003
Bonvehi, J.S.; Coll, F.V.,
Flavour index and aroma profiles of fresh and processed honeys,
J. Sci. Food Agric., 2003, 83, 4, 275-282, https://doi.org/10.1002/jsfa.1308
. [all data]
Moreira, Trugo, et al., 2002
Moreira, R.F.A.; Trugo, L.C.; Pietroluongo, M.; de Maria, C.A.B.,
Flavor composition of cashew (Anacardium occidentale) and marmeleiro (Croton species) honeys,
J. Agric. Food Chem., 2002, 50, 26, 7616-7621, https://doi.org/10.1021/jf020464b
. [all data]
Umano, Hagi, et al., 1992
Umano, K.; Hagi, Y.; Nakahara, K.; Shoji, A.; Shibamoto, T.,
Volatile constituents of green and ripened pineapple (Aanas comosus [L.] Merr.),
J. Agric. Food Chem., 1992, 40, 4, 599-603, https://doi.org/10.1021/jf00016a014
. [all data]
Baltes and Mevissen, 1988
Baltes, W.; Mevissen, L.,
Model reactions on roast aroma formation. VI. Volatile reaction products from the reaction of phenylalanine with glucose during cooking and roasting,
Z. Lebensm. Unters. Forsch., 1988, 187, 3, 209-214, https://doi.org/10.1007/BF01043341
. [all data]
Notes
Go To: Top, Van Den Dool and Kratz RI, polar column, temperature ramp, References
- Symbols used in this document:
Tend Final temperature Tstart Initial temperature - Data from NIST Standard Reference Database 69: NIST Chemistry WebBook
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