Desmetryn
- Formula: C8H15N5S
- Molecular weight: 213.303
- IUPAC Standard InChIKey: HCRWJJJUKUVORR-UHFFFAOYSA-N
- CAS Registry Number: 1014-69-3
- 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: 1,3,5-Triazine-2,4-diamine, N-methyl-N'-(1-methylethyl)-6-(methylthio)-; s-Triazine, 2-(isopropylamino)-4-(methylamino)-6-(methylthio)-; Desmetryne; G 34360; GS 34360; Norametryne; Semeron; Semeron 25; Semeron 250; Topusyn; 2-Isopropylamino-4-methylamino-6-methylthio-1,3,5-triazine; Desmethryn; 2-Isopropilamino-4-metilamino-6-metiltio-1,3,5-triazina; 2-Isopropylamino-4-methylamino-6-methylmercapto-s-triazine; 2-Methylamino-4-methylthio-6-isopropylamino-1,3,5-triazine; Methylmercapto-4-isopropylamino-6-methylamino-s-triazine; 2-Methylthio-4-isopropylamino-6-methylamino-s-triazine; 2-(Methylthio)-4-(methylamino)-6-(isopropylamino)-s-triazine; Samuron; 2-Methylthio-4-methylamino-6-isopropylamine-1,3,5-triazine; Methylamino-4-methylthio-6-isopropylamino-1,3,5-triazine; Methylthio-4-isopropylamino-6-methylamino-s-triazine; N-Methyl-N'-(1-methylethyl)-6-(methylthio)-1,3,5-triazine-2,4-diamine; Triazine, 2-(isopropylamino)-4-(methylamino)-6-(methylthio)-; 2-Methylmercapto-4-methylamino-6-isopropylamino-s-triazine; 2-Methylthio-4-methylamino-6-isopropyl-1,3,5-triazine
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Phase change data
Go To: Top, Mass spectrum (electron ionization), 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: William E. Acree, Jr., James S. Chickos
Enthalpy of sublimation
ΔsubH (kcal/mol) | Temperature (K) | Method | Reference | Comment |
---|---|---|---|---|
24.26 | 338. | GS-GC | Stephenson and Malanowski, 1987 | Based on data from 323. to 357. K. See also Friedrich and Stammbach, 1964. |
Mass spectrum (electron ionization)
Go To: Top, Phase change data, 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: NIST Mass Spectrometry Data Center, William E. Wallace, director
Spectrum
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Additional Data
View image of digitized spectrum (can be printed in landscape orientation).
Due to licensing restrictions, this spectrum cannot be downloaded.
Owner | NIST Mass Spectrometry Data Center Collection (C) 2014 copyright by the U.S. Secretary of Commerce on behalf of the United States of America. All rights reserved. |
---|---|
Origin | NIST Mass Spectrometry Data Center, 1998. |
NIST MS number | 291906 |
Gas Chromatography
Go To: Top, Phase change data, Mass spectrum (electron ionization), 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 |
---|---|---|---|---|---|
Capillary | OV-1 | 160. | 1815. | Erdmann, Rochholz, et al., 1992 | |
Capillary | OV-1 | 190. | 1827. | Erdmann, Rochholz, et al., 1992 | |
Capillary | OV-1 | 220. | 1836. | Erdmann, Rochholz, et al., 1992 | |
Capillary | OV-101 | 190. | 1848. | Valko and Lopata, 1982 | |
Capillary | OV-101 | 190. | 1848. | Matisová, Krupcík, et al., 1979 | N2; Column length: 69.7 m; Column diameter: 0.24 mm |
Kovats' RI, polar column, isothermal
Column type | Active phase | Temperature (C) | I | Reference | Comment |
---|---|---|---|---|---|
Packed | Carbowax 20M | 215. | 2868. | Leclercq and Pacáková, 1979 | N2, Chromosorb W |
Packed | Carbowax 20M | 190. | 2889. | Matisová, Krupcík, et al., 1979 | N2, Chromosorb W AW (80-100 mesh); Column length: 1.3 m |
Packed | Carbowax 20M | 215. | 2868. | Pacáková and Nemec, 1978 | N2, Chromosorb W; Column length: 1.4 m |
References
Go To: Top, Phase change data, Mass spectrum (electron ionization), Gas Chromatography, Notes
Data compilation copyright by the U.S. Secretary of Commerce on behalf of the U.S.A. All rights reserved.
Stephenson and Malanowski, 1987
Stephenson, Richard M.; Malanowski, Stanislaw,
Handbook of the Thermodynamics of Organic Compounds, 1987, https://doi.org/10.1007/978-94-009-3173-2
. [all data]
Friedrich and Stammbach, 1964
Friedrich, K.; Stammbach, K.,
Gas chromatographic determination of small vapour pressures determination of the vapour pressures of some triazine herbicides,
Journal of Chromatography A, 1964, 16, 22-28, https://doi.org/10.1016/S0021-9673(01)82436-5
. [all data]
Erdmann, Rochholz, et al., 1992
Erdmann, F.; Rochholz, G.; Schütz, H.,
Retention-indices on OV-1 of approximately 170 commonly used pesticides,
Mikrochim. Acta, 1992, 106, 3-6, 219-226, https://doi.org/10.1007/BF01242093
. [all data]
Valko and Lopata, 1982
Valko, K.; Lopata, A.,
Applicability of Gas-Liquid Chromatography in Determining Liquid-Liquid Partition Data,
J. Chromatogr., 1982, 252, 77-90, https://doi.org/10.1016/S0021-9673(01)88399-0
. [all data]
Matisová, Krupcík, et al., 1979
Matisová, E.; Krupcík, J.; Líska, O.; Szentiványi, N.,
Qualitative analysis of multi-component s-triazine herbicides by gas-liquid chromatography,
J. Chromatogr., 1979, 169, 261-269, https://doi.org/10.1016/0021-9673(75)85049-7
. [all data]
Leclercq and Pacáková, 1979
Leclercq, P.A.; Pacáková, V.,
Gas Chromatography and Mass Spectrometry of Bis(alkylamino)-s-triazines,
J. Chromatogr., 1979, 178, 1, 193-207, https://doi.org/10.1016/S0021-9673(00)89708-3
. [all data]
Pacáková and Nemec, 1978
Pacáková, V.; Nemec, I.,
Gas chromatographic, spectrophotometric and electrochemical behaviour of subsitituted s-triazines,
J. Chromatogr., 1978, 148, 1, 273-281, https://doi.org/10.1016/S0021-9673(00)99348-8
. [all data]
Notes
Go To: Top, Phase change data, Mass spectrum (electron ionization), Gas Chromatography, References
- Symbols used in this document:
ΔsubH Enthalpy of sublimation - Data from NIST Standard Reference Database 69: NIST Chemistry WebBook
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