Myclobutanil
- Formula: C15H17ClN4
- Molecular weight: 288.775
- IUPAC Standard InChI: InChI=1S/C15H17ClN4/c1-2-3-8-15(9-17,10-20-12-18-11-19-20)13-4-6-14(16)7-5-13/h4-7,11-12H,2-3,8,10H2,1H3
- IUPAC Standard InChIKey: HZJKXKUJVSEEFU-UHFFFAOYSA-N
- CAS Registry Number: 88671-89-0
- Chemical structure:
This structure is also available as a 2d Mol file - Other names: α-butyl-α-(4-chlorophenyl)-1H-1,2,4-triazole-1-propanenitrile; Nova; Rally; RH-3866; Systhane; 1H-1,2,4-Triazole-1-propanenitrile, α-butyl-α-(4-chlorophenyl)-; a-butyl-a-(4-chlorophenyl)-1H-1,2,4-triazole-1-propanenitrile; α-butyl-α-(4-chlorophenyl)-1H-1,2,4-triazole-1-propanenitrile (myclobutanil)
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- Other data available:
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Normal alkane RI, non-polar column, custom temperature program
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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 |
|---|---|---|---|---|
| Active phase | Siloxane, 5 % Ph | Polydimethyl siloxane, 5 % phenyl | 5 % Phenyl methyl siloxane | 5 % Phenyl methyl siloxane |
| Column length (m) | 30. | 30. | ||
| Carrier gas | Helium | Helium | ||
| Substrate | ||||
| Column diameter (mm) | 0.25 | 0.25 | ||
| Phase thickness (μm) | 0.25 | 0.25 | ||
| Program | not specified | not specified | 50 0C(1 min) 25 0C/min -> 125 0C 10 0C/min -> 300 0C (10 min) | 50 0C(1 min) 25 0C/min -> 125 0C 10 0C/min -> 300 0C (10 min) |
| I | 2210. | 2210. | 2198. | 2198. |
| Reference | VOC BinBase, 2012 | Skogerson, Wohlgemuth, et al., 2011 | Department of Food Safety and Welfare, 2006 | Department of Food Safety and Welfare, 2006 |
| 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.
VOC BinBase, 2012
VOC BinBase,
The volatile compound BinBase (VOC BinBase), 2012, retrieved from http://fiehnlab.ucdavis.edu/projects/VocBinBase and http://binbase.sourceforge.net. [all data]
Skogerson, Wohlgemuth, et al., 2011
Skogerson, K.; Wohlgemuth, G.; Fiehn, O.,
VocBinNase, 2011, retrieved from http://fiehnlab.ucdavis.edu/projects//VocBinBase. [all data]
Department of Food Safety and Welfare, 2006
Department of Food Safety, Ministry of Health; Welfare,
Analytical methods for residual compositional substances of agricultural chemicals, feed aadditives, and veterinary drugs in foods, 2006, retrieved from http://www.mhlw.go.jp/english/topics/foodsafety/positivelist060228/de/060526-1a.pdf. [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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