| SpectraBase Spectrum ID |
2mEXbTF7qQC |
| Name |
Bromacil |
| CAS Registry Number |
314-40-9 |
| Classification |
Herbicide |
| Comments |
Spectrum verified by crosschecking against external libraries (one reference spectrum with similarity >= 99% found) |
| Copyright |
Copyright © 2024 DigiLab GmbH and Wiley-VCH GmbH. All Rights Reserved. |
| Exact Mass |
260.016040665 u |
| Formula |
C9H13BrN2O2 |
| InChI |
InChI=1S/C9H13BrN2O2/c1-4-5(2)12-8(13)7(10)6(3)11-9(12)14/h5H,4H2,1-3H3,(H,11,14) |
| InChIKey |
CTSLUCNDVMMDHG-UHFFFAOYSA-N |
| Ionization Type |
Electron Ionization (EI) |
| Molecular Weight |
261.119 g/mol |
| Nominal Mass |
260 u |
| Quality |
973 |
| Retention Index |
1863 |
| SMILES |
C1(N(C(NC(=C1Br)C)=O)C(CC)C)=O |
| SPLASH |
splash10-0a4i-6590000000-8aba17a6aef7e7c11532 |
| Source of Spectrum |
DigiLab GmbH (C) 2024 |
| Synonyms |
5-Bromo-3-(1-methylpropyl)-6-methylpyrimidin-2,4-(1H,3H)-dione
5-Bromo-3-butan-2-yl-6-methyl-1H-pyrimidine-2,4-dione |
| Technique |
GC/MS |
| Wiley ID |
DD2024_000276 |
