| SpectraBase Compound ID | 1Mz2Kh0ppVv |
|---|---|
| InChI | InChI=1S/C12H14N2O4/c1-12(7-4-3-5-8(15)6-7)9(16)13-11(18)14(2)10(12)17/h6H,3-5H2,1-2H3,(H,13,16,18) |
| InChIKey | JLDHHLBFGIBRGN-UHFFFAOYSA-N |
| Mol Weight | 250.25 g/mol |
| Molecular Formula | C12H14N2O4 |
| Exact Mass | 250.095357 g/mol |
Mass Spectrum (GC)
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| SpectraBase Spectrum ID | JCegY1kGVGO |
|---|---|
| Name | 1,5-Dimethyl-5-(3-oxidanylidenecyclohexen-1-yl)-1,3-diazinane-2,4,6-trione |
| Alternate Name(s) | 1,5-Dimethyl-5-(3-oxo-1-cyclohexen-1-yl)-2,4,6(1H,3H,5H)-pyrimidinetrione 2,4,6(1H,3H,5H)-Pyrimidinetrione, 1,5-dimethyl-5-(3-oxo-1-cyclohexen-1-yl)- 1,5-Dimethyl-5-(3-oxo-1-cyclohexenyl)-1,3-diazinane-2,4,6-trione 1,5-Dimethyl-5-(3-oxocyclohexen-1-yl)-1,3-diazinane-2,4,6-trione 1,5-Dimethyl-5-(3-oxocyclohexen-1-yl)hexahydropyrimidine-2,4,6-trione 3'-Ketohexobarbital 3'-Ketohexobarbitone 3'-Oxohexobarbital 3,5-Dimethyl-5-(3-oxocyclohex-1-enyl)-hexahydropyrimidin-2,4,6-trione 3-KHXB 5-(3-ketocyclohexen-1-yl)-1,5-dimethyl-barbituric acid |
| CAS Registry Number | 427-30-5 |
| Copyright | Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula | C12H14N2O4 |
| InChI | InChI=1S/C12H14N2O4/c1-12(7-4-3-5-8(15)6-7)9(16)13-11(18)14(2)10(12)17/h6H,3-5H2,1-2H3,(H,13,16,18) |
| InChIKey | JLDHHLBFGIBRGN-UHFFFAOYSA-N |
| Molecular Weight | 250.254 g/mol |
| SMILES | N1C(C(C(N(C1=O)C)=O)(C1=CC(=O)CCC1)C)=O |
| SPLASH | splash10-000b-9370000000-fb86223b0554f2c3abc9 |
| Source of Spectrum | CJ-1992-0-0 |
| Wiley ID | 1252972 |