| SpectraBase Spectrum ID |
64ZSOv32W7l |
| Name |
5-(1-Byutyl)-5-(2-(2,4-dinitrophenoxycarbonylmethyl))barbituric acid |
| Alternate Name(s) |
2,4-Dinitrophenyl (5-butyl-2,4,6-trioxohexahydro-5-pyrimidinyl)acetate |
| Copyright |
Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula |
C16H16N4O9 |
| InChI |
InChI=1S/C16H16N4O9/c1-2-3-6-16(13(22)17-15(24)18-14(16)23)8-12(21)29-11-5-4-9(19(25)26)7-10(11)20(27)28/h4-5,7H,2-3,6,8H2,1H3,(H2,17,18,22,23,24) |
| InChIKey |
ZRTBGSZDANIMPU-UHFFFAOYSA-N |
| Molecular Weight |
408.323 g/mol |
| SMILES |
N1C(NC(C(C1=O)(CC(Oc1c(N(=O)=O)cc(N(=O)=O)cc1)=O)CCCC)=O)=O |
| SPLASH |
splash10-08mi-9800000000-9f3770b5e23965821876 |
| Source of Spectrum |
F-51-447-8 |
| Wiley ID |
790627 |
