Butanal
- Formula: C4H8O
- Molecular weight: 72.1057
- IUPAC Standard InChIKey: ZTQSAGDEMFDKMZ-UHFFFAOYSA-N
- CAS Registry Number: 123-72-8
- Chemical structure:
This structure is also available as a 2d Mol file or as a computed 3d SD file
View 3d structure (requires JavaScript / HTML 5) - Other names: Butyraldehyde; n-Butanal; n-Butyl aldehyde; n-Butyraldehyde; Butal; Butaldehyde; Butanaldehyde; Butyl aldehyde; Butyral; Butyric aldehyde; Butyrylaldehyde; n-C3H7CHO; Aldehyde butyrique; Aldeide butirrica; Butalyde; Butyraldehyd; NCI-C56291; UN 1129; 1-Butanal; Butan-1-al; NSC 62779
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Kovats' RI, non-polar column, isothermal
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-1 | DB-1 | DB-1 | DB-1 | DB-1 |
Column length (m) | 30. | 30. | 30. | 30. | 30. |
Carrier gas | |||||
Substrate | |||||
Column diameter (mm) | 0.32 | 0.32 | 0.32 | 0.32 | 0.32 |
Phase thickness (μm) | 1. | 1. | 1. | 1. | 1. |
Temperature (C) | 313. | 323. | 333. | 343. | 353. |
I | 571.50 | 570.91 | 568.78 | 569.15 | 571.57 |
Reference | Ciaznska-Halarewicz and Kowalska, 2003 | Ciaznska-Halarewicz and Kowalska, 2003 | Ciaznska-Halarewicz and Kowalska, 2003 | Ciaznska-Halarewicz and Kowalska, 2003 | Ciaznska-Halarewicz and Kowalska, 2003 |
Comment | MSDC-RI | MSDC-RI | MSDC-RI | MSDC-RI | MSDC-RI |
Column type | Capillary | Capillary | Capillary | Capillary | Capillary |
---|---|---|---|---|---|
Active phase | DB-1 | DB-1 | DB-1 | DB-1 | DB-1 |
Column length (m) | 30. | 30. | 30. | 30. | 30. |
Carrier gas | |||||
Substrate | |||||
Column diameter (mm) | 0.32 | 0.32 | 0.32 | 0.32 | 0.32 |
Phase thickness (μm) | 1. | 1. | 1. | 1. | 1. |
Temperature (C) | 363. | 373. | 383. | 393. | 403. |
I | 573.77 | 575.99 | 578.18 | 580.49 | 583.70 |
Reference | Ciaznska-Halarewicz and Kowalska, 2003 | Ciaznska-Halarewicz and Kowalska, 2003 | Ciaznska-Halarewicz and Kowalska, 2003 | Ciaznska-Halarewicz and Kowalska, 2003 | Ciaznska-Halarewicz and Kowalska, 2003 |
Comment | MSDC-RI | MSDC-RI | MSDC-RI | MSDC-RI | MSDC-RI |
Column type | Capillary | Capillary | Capillary | Capillary | Capillary |
---|---|---|---|---|---|
Active phase | DB-1 | DB-1 | DB-5 | DB-5 | HP-1 |
Column length (m) | 30. | 30. | 30. | 30. | 50. |
Carrier gas | |||||
Substrate | |||||
Column diameter (mm) | 0.32 | 0.32 | 0.32 | 0.32 | 0.32 |
Phase thickness (μm) | 1. | 1. | 1. | 1. | 1.05 |
Temperature (C) | 413. | 423. | 343. | 353. | 110. |
I | 587.66 | 588.95 | 615.44 | 618.79 | 573.33 |
Reference | Ciaznska-Halarewicz and Kowalska, 2003 | Ciaznska-Halarewicz and Kowalska, 2003 | Ciaznska-Halarewicz and Kowalska, 2003 | Ciaznska-Halarewicz and Kowalska, 2003 | Héberger, Görgényi, et al., 2002 |
Comment | MSDC-RI | MSDC-RI | MSDC-RI | MSDC-RI | MSDC-RI |
Column type | Capillary | Capillary | Capillary | Capillary | Capillary |
---|---|---|---|---|---|
Active phase | HP-1 | HP-1 | HP-1 | HP-1 | HP-1 |
Column length (m) | 50. | 50. | 50. | 50. | 50. |
Carrier gas | |||||
Substrate | |||||
Column diameter (mm) | 0.32 | 0.32 | 0.32 | 0.32 | 0.32 |
Phase thickness (μm) | 1.05 | 1.05 | 1.05 | 1.05 | 1.05 |
Temperature (C) | 20. | 30. | 50. | 70. | 90. |
I | 570.9 | 570.7 | 571.10 | 571.9 | 572.54 |
Reference | Héberger, Görgényi, et al., 2002 | Héberger, Görgényi, et al., 2002 | Héberger, Görgényi, et al., 2002 | Héberger, Görgényi, et al., 2002 | Héberger, Görgényi, et al., 2002 |
Comment | MSDC-RI | MSDC-RI | MSDC-RI | MSDC-RI | MSDC-RI |
Column type | Packed | Capillary | Capillary | Capillary | Capillary |
---|---|---|---|---|---|
Active phase | C78, Branched paraffin | HP-1 | HP-1 | HP-1 | HP-1 |
Column length (m) | 3.3 | 50. | 50. | 50. | 50. |
Carrier gas | He | N2 | N2 | N2 | N2 |
Substrate | |||||
Column diameter (mm) | 0.32 | 0.32 | 0.32 | 0.32 | |
Phase thickness (μm) | 1.05 | 1.05 | 1.05 | 1.05 | |
Temperature (C) | 130. | 110. | 50. | 70. | 90. |
I | 542.1 | 573. | 571. | 572. | 572. |
Reference | Dallos, Sisak, et al., 2000 | Héberger and Görgényi, 1999 | Héberger and Görgényi, 1999 | Héberger and Görgényi, 1999 | Héberger and Görgényi, 1999 |
Comment | MSDC-RI | MSDC-RI | MSDC-RI | MSDC-RI | MSDC-RI |
Column type | Packed | Packed | Packed | Packed | Packed |
---|---|---|---|---|---|
Active phase | SE-30 | SE-30 | Apiezon L | Apiezon L | Apiezon L |
Column length (m) | 2. | 3.7 | |||
Carrier gas | |||||
Substrate | Gaschrom Q | Celatom AW silanized | Celite 545 | Celite 545 | |
Column diameter (mm) | |||||
Phase thickness (μm) | |||||
Temperature (C) | 100. | 150. | 120. | 160. | 70. |
I | 574. | 574. | 556. | 563. | 553. |
Reference | Winskowski, 1983 | Haken, Nguyen, et al., 1979 | Bogoslovsky, Anvaer, et al., 1978 | Bogoslovsky, Anvaer, et al., 1978 | Bogoslovsky, Anvaer, et al., 1978 |
Comment | MSDC-RI | MSDC-RI | MSDC-RI | MSDC-RI | MSDC-RI |
Column type | Packed | Packed | Packed | Packed |
---|---|---|---|---|
Active phase | Apiezon L | Apiezon L | Apiezon L | Apiezon L |
Column length (m) | 2.3 | 2.3 | ||
Carrier gas | N2 | N2 | ||
Substrate | DCMS-treated Chromosorb W | DCMS-treated Chromosorb W | Celite (40:60 Gewichtsverhaltnis) | Celite (40:60 Gewichtsverhaltnis) |
Column diameter (mm) | ||||
Phase thickness (μm) | ||||
Temperature (C) | 100. | 150. | 130. | 70. |
I | 554. | 568. | 555. | 553. |
Reference | Brown, Chapman, et al., 1968 | Brown, Chapman, et al., 1968 | von Kováts, 1958 | von Kováts, 1958 |
Comment | MSDC-RI | MSDC-RI | MSDC-RI | MSDC-RI |
References
Go To: Top, Kovats' RI, non-polar column, isothermal, Notes
Data compilation copyright by the U.S. Secretary of Commerce on behalf of the U.S.A. All rights reserved.
Ciaznska-Halarewicz and Kowalska, 2003
Ciaznska-Halarewicz, K.; Kowalska, T.,
A study of the dependence of the Kováts retention index on the temperature of analysis on stationary phases of different polarity,
Acta Chromatogr., 2003, 13, 69-80. [all data]
Héberger, Görgényi, et al., 2002
Héberger, K.; Görgényi, M.; Kowalska, T.,
Temperature dependence of Kováts indices in gas chromatography revisited,
J. Chromatogr. A, 2002, 973, 1-2, 135-142, https://doi.org/10.1016/S0021-9673(02)01198-6
. [all data]
Dallos, Sisak, et al., 2000
Dallos, A.; Sisak, A.; Kulcsár, Z.; Kováts, E.,
Pair-wise interactions by gas chromatography VII. Interaction free enthalpies of solutes with secondary alcohol groups,
J. Chromatogr. A, 2000, 904, 2, 211-242, https://doi.org/10.1016/S0021-9673(00)00908-0
. [all data]
Héberger and Görgényi, 1999
Héberger, K.; Görgényi, M.,
Principal component analysis of Kováts indices for carbonyl compounds in capillary gas chromatography,
J. Chromatogr., 1999, 845, 1-2, 21-31, https://doi.org/10.1016/S0021-9673(99)00323-4
. [all data]
Winskowski, 1983
Winskowski, J.,
Gaschromatographische Identifizierung von Stoffen anhand von Indexziffem und unterschiedlichen Detektoren,
Chromatographia, 1983, 17, 3, 160-165, https://doi.org/10.1007/BF02271041
. [all data]
Haken, Nguyen, et al., 1979
Haken, J.K.; Nguyen, A.; Wainwright, M.S.,
Application of linear extrathermodynamic relationships to alcohols, aldehydes, ketones, amd ethoxy alcohols,
J. Chromatogr., 1979, 179, 1, 75-85, https://doi.org/10.1016/S0021-9673(00)80658-5
. [all data]
Bogoslovsky, Anvaer, et al., 1978
Bogoslovsky, Yu.N.; Anvaer, B.I.; Vigdergauz, M.S.,
Chromatographic constants in gas chromatography (in Russian), Standards Publ. House, Moscow, 1978, 192. [all data]
Brown, Chapman, et al., 1968
Brown, I.; Chapman, I.L.; Nicholson, G.J.,
Gas chromatography of polar solutes in electron acceptor stationary phases,
Aust. J. Chem., 1968, 21, 5, 1125-1141, https://doi.org/10.1071/CH9681125
. [all data]
von Kováts, 1958
von Kováts, E.,
206. Gas-chromatographische Charakterisierung organischer Verbindungen. Teil 1: Retentionsindices aliphatischer Halogenide, Alkohole, Aldehyde und Ketone,
Helv. Chim. Acta, 1958, 41, 7, 1915-1932, https://doi.org/10.1002/hlca.19580410703
. [all data]
Notes
Go To: Top, Kovats' RI, non-polar column, isothermal, References
- Data from NIST Standard Reference Database 69: NIST Chemistry WebBook
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