| SpectraBase Spectrum ID |
3JX0ztrg5qM |
| Name |
BROMACIL |
| CAS Registry Number |
314-40-9 |
| Copyright |
Database Compilation Copyright © 2023-2024 John Wiley and Sons, Inc. Copyright © 2023-2024 John Wiley and Sons, Inc., Portions Copyright Wiley-VCH GmbH, Adams Library under license from Diablo Analytical. 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 |
| Molecular Weight |
261.119 g/mol |
| Nominal Mass |
260 u |
| Number of Peaks |
90 |
| SMILES |
N1C(=C(C(N(C1=O)C(CC)C)=O)Br)C |
| SPLASH |
splash10-0a4i-2390000000-2bddc7f933209dc242ab |
| Source of Spectrum |
Dr. Rolf Kuehnle |
| Synonyms |
5-bromo-3-sec-butyl-6-methyl-2,4(1H,3H)-pyrimidinedione |
| Technique |
GC/MS |
| Wiley ID |
WID_MSPA_3583 |
