Benzaldehyde, 2-hydroxy-
- Formula: C7H6O2
- Molecular weight: 122.1213
- IUPAC Standard InChIKey: SMQUZDBALVYZAC-UHFFFAOYSA-N
- CAS Registry Number: 90-02-8
- 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. - Isotopologues:
- Other names: Salicylaldehyde; o-Formylphenol; o-Hydroxybenzaldehyde; Salicylal; Salicylic aldehyde; 2-Formylphenol; 2-Hydroxybenzaldehyde; Benzaldehyde, o-hydroxy-; SAH; NSC 49178; Salicylaldehyde (2-hydroxybenzaldehyde); 2-Hydroxy benzaldehyde (salicylaldehyde)
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IR Spectrum
Go To: Top, UV/Visible spectrum, Gas Chromatography, References, Notes
Data compiled by: Coblentz Society, Inc.
- SOLUTION (10% IN CCl4 FOR 4000-1350 CM-1, 10% IN CS2 FOR 1350-600 CM-1); BECKMAN IR-7 (GRATING); DIGITIZED BY NIST FROM HARD COPY (FROM TWO SEGMENTS); 4 cm-1 resolution
- VAPOR (6 MICROLITER AT 150 C); PERKIN-ELMER 180; DIGITIZED BY NIST FROM HARD COPY (FROM TWO SEGMENTS); 2-3 CM-1 cm-1 resolution
Data compiled by: NIST Mass Spectrometry Data Center, William E. Wallace, director
UV/Visible spectrum
Go To: Top, IR Spectrum, Gas Chromatography, 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: Victor Talrose, Eugeny B. Stern, Antonina A. Goncharova, Natalia A. Messineva, Natalia V. Trusova, Margarita V. Efimkina
Spectrum
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Additional Data
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Source | Grammaticakis, 1953 |
---|---|
Owner | INEP CP RAS, NIST OSRD Collection (C) 2007 copyright by the U.S. Secretary of Commerce on behalf of the United States of America. All rights reserved. |
Origin | INSTITUTE OF ENERGY PROBLEMS OF CHEMICAL PHYSICS, RAS |
Source reference | RAS UV No. 3309 |
Instrument | n.i.g. |
Melting point | -7 |
Boiling point | 197 |
Gas Chromatography
Go To: Top, IR Spectrum, UV/Visible spectrum, 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
Kovats' RI, non-polar column, isothermal
Column type | Active phase | Temperature (C) | I | Reference | Comment |
---|---|---|---|---|---|
Packed | OV-101 | 140. | 1041.4 | Righezza, Hassani, et al., 1996 | N2, Chromosorb G HP; Column length: 5. m |
Packed | OV-101 | 160. | 1047.6 | Hassani and Meklati, 1992 | N2, Chromosorb G HP; Column length: 5. m |
Capillary | SE-30 | 160. | 1062. | Evans and Haken, 1989 | Column length: 25. m; Column diameter: 0.32 mm |
Capillary | SE-30 | 140. | 1044. | Korhonen, 1984 | Column length: 25. m; Column diameter: 0.3 mm |
Capillary | SE-30 | 160. | 1062. | Korhonen, 1984 | Column length: 25. m; Column diameter: 0.3 mm |
Capillary | SE-30 | 180. | 1074. | Korhonen, 1984 | Column length: 25. m; Column diameter: 0.3 mm |
Packed | SE-30 | 150. | 1045. | Tiess, 1984 | Ar, Gas Chrom Q (80-100 mesh); Column length: 3. m |
Kovats' RI, non-polar column, temperature ramp
Column type | Active phase | I | Reference | Comment |
---|---|---|---|---|
Capillary | DB-1 | 1008. | Thangadurai, Anitha, et al., 2002 | 28. m/0.25 mm/0.25 μm, He, 50. C @ 1. min, 5.5 K/min; Tend: 270. C |
Capillary | SSP-1 | 1003. | Nagarajan, Rao, et al., 2001 | 30. m/0.32 mm/0.25 μm, He, 50. C @ 2. min, 2. K/min, 250. C @ 5. min |
Capillary | OV-101 | 1031. | Yamaguchi and Shibamoto, 1979 | N2, 2. K/min; Column length: 70. m; Column diameter: 0.28 mm; Tstart: 80. C; Tend: 200. C |
Capillary | OV-101 | 1029. | Yamaguchi and Shibamoto, 1979 | N2, 2. K/min; Column length: 70. m; Column diameter: 0.28 mm; Tstart: 80. C; Tend: 200. C |
Kovats' RI, polar column, isothermal
Column type | Active phase | Temperature (C) | I | Reference | Comment |
---|---|---|---|---|---|
Capillary | OV-351 | 180. | 1699. | Korhonen, 1984 | Column length: 25. m; Column diameter: 0.32 mm |
Kovats' RI, polar column, temperature ramp
Column type | Active phase | I | Reference | Comment |
---|---|---|---|---|
Capillary | DB-Wax | 1636. | Nagarajan, Rao, et al., 2001 | 30. m/0.25 mm/0.25 μm, He, 60. C @ 5. min, 2. K/min, 220. C @ 5. min |
Capillary | DB-Wax | 1660. | Nagarajan, Rao, et al., 2001, 2 | 30. m/0.25 mm/0.25 μm, He, 60. C @ 5. min, 2. K/min, 220. C @ 5. min |
Van Den Dool and Kratz RI, non-polar column, temperature ramp
Column type | Active phase | I | Reference | Comment |
---|---|---|---|---|
Capillary | DB-5 | 1057. | Methven L., Tsoukka M., et al., 2007 | 60. m/0.32 mm/1. μm, 40. C @ 2. min, 4. K/min, 260. C @ 10. min |
Capillary | RTX-1 | 1013. | Muselli, Rossi, et al., 2007 | 60. m/0.22 mm/0.25 μm, He, 2. K/min, 230. C @ 30. min; Tstart: 60. C |
Capillary | DB-5MS | 1049. | Radulovic, Misic, et al., 2007 | 30. m/0.25 mm/0.25 μm, H2, 4.3 K/min; Tstart: 40. C; Tend: 285. C |
Capillary | HP-5MS | 1041. | Pino, Mesa, et al., 2005 | 30. m/0.25 mm/0.25 μm, He, 60. C @ 2. min, 4. K/min, 250. C @ 20. min |
Capillary | PE-5 | 1041. | Isidorov and Vinogorova, 2003 | He, 3. K/min; Column length: 30. m; Column diameter: 0.25 mm; Tstart: 40. C; Tend: 280. C |
Capillary | HP-5MS | 1041. | Papandreou, Magiatis, et al., 2002 | 30. m/0.25 mm/0.25 μm, 60. C @ 5. min, 3. K/min; Tend: 280. C |
Capillary | CP Sil 5 CB | 1011. | Pino and Marbot, 2001 | 50. m/0.32 mm/0.4 μm, He, 60. C @ 10. min, 3. K/min, 280. C @ 60. min |
Capillary | DB-1 | 1026. | Kaiser and Siegl, 1994 | 60. m/0.32 mm/1. μm, -50. C @ 4. min, 6. K/min; Tend: 180. C |
Capillary | SE-30 | 1031. | Korhonen, 1984 | 10. K/min; Column length: 25. m; Column diameter: 0.3 mm; Tstart: 100. C |
Capillary | SE-30 | 1021. | Korhonen, 1984 | 2. K/min; Column length: 25. m; Column diameter: 0.3 mm; Tstart: 100. C |
Capillary | SE-30 | 1025. | Korhonen, 1984 | 6. K/min; Column length: 25. m; Column diameter: 0.3 mm; Tstart: 100. C |
Van Den Dool and Kratz RI, non-polar column, custom temperature program
Column type | Active phase | I | Reference | Comment |
---|---|---|---|---|
Capillary | HP-1 | 1024. | Sing, Smadja, et al., 1992 | 50. m/0.32 mm/1.05 μm, He; Program: 20C(0.5min) => 60C => 4C/min => 250C |
Van Den Dool and Kratz RI, polar column, temperature ramp
Column type | Active phase | I | Reference | Comment |
---|---|---|---|---|
Capillary | RTX-Wax | 1633. | Muselli, Rossi, et al., 2007 | 60. m/0.22 mm/0.25 μm, He, 2. K/min, 230. C @ 30. min; Tstart: 60. C |
Capillary | OV-351 | 1663. | Bonvehí, 2005 | 50. m/0.32 mm/0.2 μm, He, 5. K/min; Tstart: 60. C; Tend: 220. C |
Capillary | HP-Innowax | 1704. | Adamiec, Rossner, et al., 2001 | 30. m/0.25 mm/0.25 μm, N2, 5. K/min; Tstart: 60. C; Tend: 220. C |
Capillary | AT-Wax | 1658. | Pino and Marbot, 2001 | 60. m/0.32 mm/0.25 μm, He, 65. C @ 10. min, 2. K/min, 250. C @ 60. min |
Capillary | DB-Wax | 1663. | Shimoda, Shigematsu, et al., 1995 | 60. m/0.25 mm/0.25 μm, 2. K/min; Tstart: 50. C; Tend: 230. C |
Capillary | DB-Wax | 1674. | Shiratsuchi, Shimoda, et al., 1994 | 60. m/0.25 mm/0.25 μm, 2. K/min, 230. C @ 60. min; Tstart: 50. C |
Capillary | DB-Wax | 1674. | Shiratsuchi, Shimoda, et al., 1994, 2 | 60. m/0.25 mm/0.25 μm, He, 2. K/min, 230. C @ 60. min; Tstart: 50. C |
Capillary | OV-351 | 1652. | Korhonen, 1984 | 10. K/min; Column length: 25. m; Column diameter: 0.32 mm; Tstart: 100. C |
Van Den Dool and Kratz RI, polar column, custom temperature program
Column type | Active phase | I | Reference | Comment |
---|---|---|---|---|
Capillary | HP-Innowax | 1680. | Bisio, Ciarallo, et al., 1998 | 30. m/0.25 mm/0.25 μm, He; Program: 60C(8min) => 3C/min => 180C(5min) => 40C/min => 250C |
Capillary | Supelcowax-10 | 1701. | Sing, Smadja, et al., 1992 | 60. m/0.25 mm/0.25 μm, He; Program: 20C(0.5min) => 60C => 4C/min => 250C |
Normal alkane RI, non-polar column, temperature ramp
Column type | Active phase | I | Reference | Comment |
---|---|---|---|---|
Capillary | VF-5 MS | 1046. | Leffingwell and Alford, 2011 | 60. m/0.32 mm/0.25 μm, Helium, 2. K/min, 260. C @ 28. min; Tstart: 30. C |
Capillary | VF-5 MS | 1049. | Leffingwell and Alford, 2011 | 60. m/0.32 mm/0.25 μm, Helium, 2. K/min, 260. C @ 28. min; Tstart: 30. C |
Capillary | HP-5 MS | 1047. | Lazarevic, Radulovic, et al., 2010 | 30. m/0.25 mm/0.25 μm, Helium, 5. K/min; Tstart: 70. C; Tend: 290. C |
Capillary | HP-5 MS | 1047. | Radulovic, Blagojevic, et al., 2010 | 30. m/0.25 mm/0.25 μm, Helium, 5. K/min, 290. C @ 10. min; Tstart: 70. C |
Capillary | HP-5 MS | 1047. | Radulovic, Dordevic, et al., 2010 | 30. m/0.25 mm/0.25 μm, Helium, 5. K/min, 290. C @ 10. min; Tstart: 70. C |
Capillary | ZP-5 | 1063. | Füssel, Dötterl, et al., 2007 | 60. m/0.25 mm/0.25 μm, He, 40. C @ 7. min, 6. K/min, 260. C @ 1. min |
Capillary | HP-5 | 1040. | Pavlovic, Petrovic, et al., 2007 | 25. m/0.32 mm/0.52 μm, Helium, 4. K/min; Tstart: 40. C; Tend: 280. C |
Capillary | HP-5 | 1041.3 | Leffingwell and Alford, 2005 | 60. m/0.32 mm/0.25 μm, He, 30. C @ 2. min, 2. K/min, 260. C @ 28. min |
Capillary | MDN-5 | 1048. | van Loon, Linssen, et al., 2005 | 60. m/0.25 mm/0.25 μm, He, 40. C @ 4. min, 4. K/min, 270. C @ 5. min |
Capillary | DB-5 | 1041. | Woerdenbag, Windono, et al., 2004 | 30. m/0.249 mm/0.25 μm, He, 3. K/min; Tstart: 60. C; Tend: 300. C |
Capillary | DB-5MS | 1049. | Fernando and Grün, 2001 | 60. m/0.25 mm/0.25 μm, He, 35. C @ 5. min, 3. K/min; Tend: 250. C |
Capillary | SE-54 | 1011. | Ding, Deng, et al., 1998 | 35. C @ 3. min, 4. K/min; Column length: 25. m; Column diameter: 0.31 mm; Tend: 250. C |
Capillary | Ultra-1 | 1012. | Okumura, 1991 | 25. m/0.32 mm/0.25 μm, He, 3. K/min; Tstart: 80. C; Tend: 260. C |
Capillary | DB-1 | 1008. | Habu, Flath, et al., 1985 | 3. K/min; Column length: 50. m; Column diameter: 0.32 mm; Tstart: 0. C; Tend: 250. C |
Capillary | DB-1 | 1005. | Habu, Flath, et al., 1985 | 3. K/min; Column length: 50. m; Column diameter: 0.32 mm; Tstart: 50. C; Tend: 250. C |
Normal alkane RI, non-polar column, custom temperature program
Column type | Active phase | I | Reference | Comment |
---|---|---|---|---|
Capillary | TR-5 MS | 1033. | Kurashov, Mitrukova, et al., 2014 | 15. m/0.25 mm/0.25 μm, Helium; Program: 35 0C (3 min) 2 0C/min -> 60 0C (3 min) 2 0C/min -> 80 0C (3 min) 4 0C/min -> 120 0C (3 min) 5 0C/min -> 150 0C (3 min) 15 0C/min -> 240 0C (10 min) |
Capillary | Polydimethyl siloxane with 5 % Ph groups | 1055. | Robinson, Adams, et al., 2012 | Program: not specified |
Capillary | Polydimethyl siloxane with 5 % Ph groups | 1057. | Robinson, Adams, et al., 2012 | Program: not specified |
Capillary | HP-5 | 1047. | Zhao, Li, et al., 2008 | 30. m/0.25 mm/0.25 μm; Program: 40 0C (2 min) 5 0C/min -> 80 0C 7 oC/min -> 160 0C 9 0C/min -> 200 0C 20 0C/min -> 280 0C (10 min) |
Capillary | HP-5 | 1049. | Zhao, Li, et al., 2008 | 30. m/0.25 mm/0.25 μm; Program: not specified |
Capillary | HP-5 | 1045. | Pavlovic, Petrovic, et al., 2007 | 25. m/0.32 mm/0.52 μm, Helium; Program: not specified |
Capillary | Methyl Silicone | 1062. | Feng, Yue, et al., 2006 | Program: not specified |
Capillary | SE-30 | 1027. | Vinogradov, 2004 | Program: not specified |
Capillary | Methyl phenyl siloxane (not specified) | 1054. | Poligne, Collignan, et al., 2002 | Program: not specified |
Capillary | SE-54 | 1013. | Ding, Deng, et al., 1998 | Column length: 25. m; Column diameter: 0.31 mm; Program: not specified |
Capillary | SE-54 | 1013. | Ding, Deng, et al., 1998 | Column length: 25. m; Column diameter: 0.31 mm; Program: not specified |
Other | Methyl Silicone | 1072. | Ardrey and Moffat, 1981 | Program: not specified |
Normal alkane RI, polar column, temperature ramp
Column type | Active phase | I | Reference | Comment |
---|---|---|---|---|
Capillary | HP-20M | 1628. | Mastelic, Jerkovic, et al., 2006 | 50. m/0.2 mm/0.2 μm, He, 70. C @ 4. min, 4. K/min, 180. C @ 15. min |
Capillary | DB-Wax | 1653. | Parada, Duque, et al., 2000 | 30. m/0.25 mm/0.25 μm, He, 50. C @ 3. min, 4. K/min, 240. C @ 10. min |
Capillary | PEG-20M | 1669. | Ding, Deng, et al., 1998 | 2. K/min; Column length: 25. m; Column diameter: 0.25 mm; Tstart: 50. C; Tend: 230. C |
Capillary | DB-Wax | 1670. | Werkhoff, Güntert, et al., 1998 | 60. m/0.32 mm/0.25 μm, H2, 3. K/min; Tstart: 60. C; Tend: 220. C |
Capillary | DB-Wax | 1675. | Steullet and Guerin, 1994 | H2, 60. C @ 5. min, 8. K/min, 230. C @ 10. min; Column length: 30. m; Phase thickness: 0.25 μm |
Capillary | DB-Wax | 1677. | Steullet and Guerin, 1994 | H2, 60. C @ 5. min, 8. K/min, 230. C @ 10. min; Column length: 30. m; Phase thickness: 0.25 μm |
Capillary | DB-Wax | 1682. | Steullet and Guerin, 1994 | 30. m/0.25 mm/0.25 μm, He, 60. C @ 5. min, 8. K/min, 230. C @ 10. min |
Capillary | DB-Wax | 1682. | Steullet and Guerin, 1994 | 30. m/0.25 mm/0.25 μm, He, 60. C @ 5. min, 8. K/min, 230. C @ 10. min |
Capillary | DB-Wax | 1686. | Steullet and Guerin, 1994 | 30. m/0.25 mm/0.25 μm, He, 60. C @ 5. min, 8. K/min, 230. C @ 10. min |
Capillary | DB-Wax | 1689. | Steullet and Guerin, 1994 | 30. m/0.25 mm/0.25 μm, He, 60. C @ 5. min, 8. K/min, 230. C @ 10. min |
Normal alkane RI, polar column, custom temperature program
Column type | Active phase | I | Reference | Comment |
---|---|---|---|---|
Capillary | DB-Wax | 1670. | Welke, Manfroi, et al., 2012 | 30. m/0.25 mm/0.25 μm, Helium; Program: not specified |
Capillary | HP-Innowax FSC | 1703. | Suleimenov Y.M., Atazhanova G.A., et al., 2006 | 60. m/0.25 mm/0.25 μm, He; Program: 60(10min) => 4C/min => 220C(10min) => 1C/min => 240C |
Capillary | Carbowax 20M | 1705. | Vinogradov, 2004 | Program: not specified |
Capillary | HP-Innowax | 1703. | Gören, Demirci, et al., 2001 | 60. m/0.25 mm/0.25 μm, He; Program: 60 0C (10 min) 4 K/min -> 220 0C (10 min) 1 K/min -> 240 0C |
Capillary | PEG-20M | 1667. | Ding, Deng, et al., 1998 | Column length: 25. m; Column diameter: 0.25 mm; Program: not specified |
Capillary | DB-Wax | 1665. | Peng, Yang, et al., 1991 | Program: not specified |
References
Go To: Top, IR Spectrum, UV/Visible spectrum, Gas Chromatography, Notes
Data compilation copyright by the U.S. Secretary of Commerce on behalf of the U.S.A. All rights reserved.
Grammaticakis, 1953
Grammaticakis, P.,
Contribution a l'etude de l'absorption dans l'U.-V. moyen et le visible de quelques aldehydes et cetones aromatiques ainsi que de certains de leurs derives fonctionnels, (Premier memoire),
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Righezza, Hassani, et al., 1996
Righezza, M.; Hassani, A.; Meklati, B.Y.; Chrétien, J.R.,
Quantitative structure-retention relationships (QSRR) of congeneric aromatics series studied on phenyl OV phases in gas chromatography,
J. Chromatogr. A, 1996, 723, 1, 77-91, https://doi.org/10.1016/0021-9673(95)00816-0
. [all data]
Hassani and Meklati, 1992
Hassani, A.; Meklati, B.Y.,
Gas chromatographic behaviour of monosubstituted benzenes, benzaldehydes and acetophenones on OV polymethylphenyl-silicone stationary phases,
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Evans and Haken, 1989
Evans, M.B.; Haken, J.K.,
Dispersion and selectivity indices in gas chromatography. IV. Chlorinated aromatic compounds,
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Korhonen, 1984
Korhonen, I.O.O.,
Gas-liquid chromatographic analyses. XXX. Separation and retention increments of chlorinated salicylaldehydes (2-hydroxybenzaldehydes ) on low-polarity (SE-30) and polar (OV-351) capillary columns,
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Tiess, 1984
Tiess, D.,
Gaschromatographische Retentionsindices von 125 leicht- bis mittelflüchtigen organischen Substanzen toxikologisch-analytischer Relevanz auf SE-30,
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Thangadurai, Anitha, et al., 2002
Thangadurai, D.; Anitha, S.; Pullaiah, T.; Reddy, P.N.; Ramachandraiah, O.S.,
Essential oil constituents and in vitro antimicrobial activity of Decalepis hamiltonii roots against foodborne pathogens,
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Chemical composition of the volatiles of Hemidesmus indicus R. Br.,
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Volatile constituents of Castanopsis flower,
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Nagarajan, S.; Rao, L.J.M.; Guirudutt, K.N.,
Chemical composition of the volatiles of Decalepis hamiltonii (Wight Arn),
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Influence of sulfur amino acids on the volatile and nonvolatile components of cooked salmon (Salmo salar),
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Volatile components from mango (Mangifera indica L.) cultivars,
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Kaiser and Siegl, 1994
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High resolution gas chromatographic determination of the atmospheric reactivity of engine-out hydrocarbon emissions from a spark-ignited engine,
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Sing, Smadja, et al., 1992
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Bonvehí, 2005
Bonvehí, J.S.,
Investigation of aromatic compounds in roasted cocoa powder,
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. [all data]
Notes
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