2,4,6(1H,3H,5H)-Pyrimidinetrione, 1,3-dimethyl-5-(1-methylbutyl)-5-(2-propenyl)-
- Formula: C14H22N2O3
- Molecular weight: 266.3361
- IUPAC Standard InChI: InChI=1S/C14H22N2O3/c1-6-8-10(3)14(9-7-2)11(17)15(4)13(19)16(5)12(14)18/h7,10H,2,6,8-9H2,1,3-5H3
- IUPAC Standard InChIKey: KKPCLTFASPTTIQ-UHFFFAOYSA-N
- CAS Registry Number: 28239-49-8
- 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. - Other names: Barbituric acid, 5-allyl-1,3-dimethyl-5-(1-methylbutyl)-; N,N-Dimethylquinalbarbitone; 1,3-Dimethylsecobarbital; 5-Allyl-1,3-dimethyl-5-(1-methylbutyl)-2,4,6(1H,3H,5H)-pyrimidinetrione; Secobarbital, 1,3-dimethyl; Secobarbital, (bis-Me); Secobarbital permethylated; Secobarbital Me
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Gas Chromatography
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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
Kovats' RI, non-polar column, isothermal
| Column type | Active phase | Temperature (C) | I | Reference | Comment |
|---|---|---|---|---|---|
| Packed | SE-30 | 180. | 1680. | Gambaro, Mariani, et al., 1982 | Gas Chrom P (100-120 mesh); Column length: 1.8 m |
| Packed | SE-30 | 180. | 1680. | Gambaro, Mariani, et al., 1982 | Gas Chrom P (100-120 mesh); Column length: 1.8 m |
| Packed | SE-30 | 180. | 1680. | Gambaro, Mariani, et al., 1982 | Gas Chrom P (100-120 mesh); Column length: 1.8 m |
| Packed | SE-30 | 180. | 1699. | Gambaro, Mariani, et al., 1982 | Gas Chrom P (100-120 mesh); Column length: 1.8 m |
Normal alkane RI, non-polar column, temperature ramp
| Column type | Active phase | I | Reference | Comment |
|---|---|---|---|---|
| Packed | SE-30 | 1670. | MHA, 9999 | Nitrogen, Chromosorb G AW DMCS (80-100 mesh); Column length: 2. m; Tstart: 100. C; Tend: 300. C |
References
Go To: Top, Gas Chromatography, Notes
Data compilation copyright by the U.S. Secretary of Commerce on behalf of the U.S.A. All rights reserved.
Gambaro, Mariani, et al., 1982
Gambaro, V.; Mariani, R.; Marozzi, E.,
Flash alkylation for the identification of barbiturates in biological material,
J. Anal. Toxicol., 1982, 6, 6, 321-323, https://doi.org/10.1093/jat/6.6.321
. [all data]
MHA, 9999
MHA, Directorate of ForensicScience.,
Forensic Toxicology, 9999. [all data]
Notes
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- Data from NIST Standard Reference Database 69: NIST Chemistry WebBook
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