Pentanal, PFBO # 1
- Formula: C12H12F5NO
- Molecular weight: 281.2218
- IUPAC Standard InChI: InChI=1S/C12H12F5NO/c1-2-3-4-5-18-19-6-7-8(13)10(15)12(17)11(16)9(7)14/h5H,2-4,6H2,1H3
- IUPAC Standard InChIKey: CQVUQQBKUBLHIZ-UHFFFAOYSA-N
- Chemical structure:
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Gas Chromatography
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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
Kovats' RI, non-polar column, temperature ramp
| Column type | Active phase | I | Reference | Comment |
|---|---|---|---|---|
| Capillary | DB-1 | 1360. | Spiteller, Kern, et al., 2001 | 30. m/0.32 mm/0.10 μm, H2, 60. C @ 5. min, 3. K/min, 280. C @ 15. min |
Normal alkane RI, non-polar column, custom temperature program
| Column type | Active phase | I | Reference | Comment |
|---|---|---|---|---|
| Capillary | ZB-5 | 1364. | Schmarr, Potouridis, et al., 2008 | 30. m/0.25 mm/0.50 μm, Helium; Program: 50 0C (3 min) 20 0C/min -> 125 0C (0.5 min) 5 0C/min -> 255 0C (0.5 min) 20 0C/min -> 300 0C (5 min) |
Normal alkane RI, polar column, temperature ramp
| Column type | Active phase | I | Reference | Comment |
|---|---|---|---|---|
| Capillary | ZB-Wax | 1664. | Schmarr, Potouridis, et al., 2008 | 30. m/0.25 mm/0.50 μm, Helium, 35. C @ 5. min, 4. K/min, 250. C @ 10. min |
References
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Data compilation copyright by the U.S. Secretary of Commerce on behalf of the U.S.A. All rights reserved.
Spiteller, Kern, et al., 2001
Spiteller, P.; Kern, W.; Reiner, J.; Spiteller, G.,
Aldehydic lipid peroxidation products derived from linoleic acid,
Biochim. Biophys. Acta, 2001, 1531, 3, 188-208, https://doi.org/10.1016/S1388-1981(01)00100-7
. [all data]
Schmarr, Potouridis, et al., 2008
Schmarr, H.-G.; Potouridis, T.; Gans, S.; Sang, W.; Kopp, B.; Bokuz, U.; Fischer, U.,
Analysis of carbonyl compounds via headspace solid-phase microectraction with on-fiber derivatization and gas chromatographic-ion trap tandem mass spectrometric determination of their O-(2,3,4,5,6-pentafluorobenzyl)oxime derivatives,
Anal. Chim. Acta, 2008, 617, 1-2, 119-131, https://doi.org/10.1016/j.aca.2008.02.002
. [all data]
Notes
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- Data from NIST Standard Reference Database 69: NIST Chemistry WebBook
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