Ethanone, 1-(2-aminophenyl)-
- Formula: C8H9NO
- Molecular weight: 135.1632
- IUPAC Standard InChI: InChI=1S/C8H9NO/c1-6(10)7-4-2-3-5-8(7)9/h2-5H,9H2,1H3
- IUPAC Standard InChIKey: GTDQGKWDWVUKTI-UHFFFAOYSA-N
- CAS Registry Number: 551-93-9
- 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. - Other names: Acetophenone, 2'-amino-; o-Aminoacetophenone; o-Aminoacetylbenzene; 2-Acetylaniline; 2'-Aminoacetophenone; 2-Aminoacetophenone; o-Aminophenyl methyl ketone; 1-Acetyl-2-aminobenzene; ortho-Aminoacetophenone; 2-Acetylphenylamine; NSC 8820; o-Acetylaniline; 1-(2-Aminophenyl)ethanone; ortho-aminoacetophenone (2'-aminoacetophenone)
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Normal alkane RI, non-polar column, custom temperature program
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-5 | CP-Sil5 CB MS | CP-Sil 5 CB | CP-Sil 5 CB | SE-30 |
| Column length (m) | 30. | 50. | 50. | 50. | |
| Carrier gas | N2 | Nitrogen | Nitrogen | ||
| Substrate | |||||
| Column diameter (mm) | 0.32 | 0.32 | 0.32 | 0.32 | |
| Phase thickness (μm) | 0.25 | 1.2 | 1.2 | 1.20 | |
| Program | 40C(2min) => 40C/min => 60C(2min) => 6C/min => 180C => 15C/min => 230C(10min) | 36C => 20C/min => 85C => 1C/min => 145C => 3C/min => 250C(30min) | 36 0C 20 0C/min -> 85 0C 1 iC/min -> 145 0C 3 0C/min -> 250 0C | 36 0C 20 0C/min -> 85 0C 1 0C/min -> 145 0C 3 0C/min -> 250 0C | not specified |
| I | 1300. | 1262. | 1262. | 1262. | 1288. |
| Reference | Buettner, 2007 | Callemien, Dasnoy, et al., 2006 | Callamien, Dasnoy, et al., 2005 | Callemien, Dasnoy, et al., 2005 | Vinogradov, 2004 |
| Comment | MSDC-RI | MSDC-RI | MSDC-RI | MSDC-RI | MSDC-RI |
| Column type | Capillary | Capillary | Capillary | Capillary |
|---|---|---|---|---|
| Active phase | CP-Sil 5 CB | CP Sil 5 CB | CP Sil 5 CB | DB-5 |
| Column length (m) | 50. | 50. | 50. | 30. |
| Carrier gas | Helium | He | ||
| Substrate | ||||
| Column diameter (mm) | 0.32 | 0.32 | 0.32 | 0.32 |
| Phase thickness (μm) | 1.20 | 1.2 | 1.2 | 0.25 |
| Program | 36 0C 20 0C/min -> 85 0C 1 0C/min -> 145 0C 3 0C/min -> 250 0C (30 min) | 36C => 20C/min => 120C(20min) => 2C/min => 250C(30min) | 30C => 55C/min => 85C => 1C/min => 145C => 3C/min => 250C | 35C (1min) => 40C/min => 60C (1min) => 6C/min => 250C (10min) |
| I | 1265. | 1274. | 1260. | 1300. |
| Reference | Gijs, Chevanese, et al., 2002 | Lermusieau, Bulens, et al., 2001 | Guyot, Bouseta, et al., 1998 | Guth, 1997 |
| Comment | MSDC-RI | MSDC-RI | MSDC-RI | MSDC-RI |
References
Go To: Top, Normal alkane RI, non-polar column, custom temperature program, Notes
Data compilation copyright by the U.S. Secretary of Commerce on behalf of the U.S.A. All rights reserved.
Buettner, 2007
Buettner, A.,
A selective and sensitive approach to characterize odour-active and volatile constituents in small-scale human milk samples,
Flavour Fragr. J., 2007, 22, 6, 465-473, https://doi.org/10.1002/ffj.1822
. [all data]
Callemien, Dasnoy, et al., 2006
Callemien, D.; Dasnoy, S.; Collin, S.,
Identification of a stale-beer-like odorant in extracts of naturally aged beer,
J. Agric. Food Chem., 2006, 54, 4, 1409-1413, https://doi.org/10.1021/jf051772n
. [all data]
Callamien, Dasnoy, et al., 2005
Callamien, D.; Dasnoy, S.; Heynen, O.; Badot, C.; Collin, S.,
Flavour stability of lager beer: identification of a new key staling compounds,
Eur. Brewery Convention, 2005, 91, 815-822. [all data]
Callemien, Dasnoy, et al., 2005
Callemien, D.; Dasnoy, S.; Heynen, O.; Badot, C.; Collin, S.,
Flavour stability of lager beer: identification of a new key staling compound
in European Brewery Convention, Fachverlag Hans Carl, Nurnberg, Germany, 2005, 815-822. [all data]
Vinogradov, 2004
Vinogradov, B.A.,
Production, composition, properties and application of essential oils, 2004, retrieved from http://viness.narod.ru. [all data]
Gijs, Chevanese, et al., 2002
Gijs, L.; Chevanese, F.; Jerkovic, V.; Collin, S.,
How low pH can intensify beta-damascenone and dimethyl trisulfide production through beer aging,
J. Agric. Food Chem., 2002, 50, 20, 5612-5616, https://doi.org/10.1021/jf020563p
. [all data]
Lermusieau, Bulens, et al., 2001
Lermusieau, G.; Bulens, M.; Collin, S.,
Use of GC-olfactometry to identify the hop aromatic compounds in beer,
J. Agric. Food Chem., 2001, 49, 8, 3867-3874, https://doi.org/10.1021/jf0101509
. [all data]
Guyot, Bouseta, et al., 1998
Guyot, C.; Bouseta, A.; Scheirman, V.; Collin, S.,
Floral origin markers of chestnut and lime tree honeys,
J. Agric. Food Chem., 1998, 46, 2, 625-633, https://doi.org/10.1021/jf970510l
. [all data]
Guth, 1997
Guth, H.,
Identification of character impact odorants of different white wine varieties,
J. Agric. Food Chem., 1997, 45, 8, 3022-3026, https://doi.org/10.1021/jf9608433
. [all data]
Notes
Go To: Top, Normal alkane RI, non-polar column, custom temperature program, References
- Data from NIST Standard Reference Database 69: NIST Chemistry WebBook
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