| SpectraBase Spectrum ID |
7GBSL1OUwbO |
| Name |
{4-Bromo-2-[(1,3-dimethyl-2,4,6-trioxotetrahydro-5(2H)-pyrimidinylidene)methyl]phenoxy}acetonitrile |
| Comments |
Computed using HOSE algorithm |
| Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass |
377.001118874 u |
| Formula |
C15H12BrN3O4 |
| InChI |
InChI=1S/C15H12BrN3O4/c1-18-13(20)11(14(21)19(2)15(18)22)8-9-7-10(16)3-4-12(9)23-6-5-17/h3-4,7-8H,6H2,1-2H3 |
| InChIKey |
WDCIYYXIIDVHHD-UHFFFAOYSA-N |
| Molecular Weight |
378.182 g/mol |
| SMILES |
CN1C(N(C)C(C(C1=O)=CC1=C(OCC#N)C=CC(Br)=C1)=O)=O |
![{4-bromo-2-[(1,3-dimethyl-2,4,6-trioxotetrahydro-5(2H)-pyrimidinylidene)methyl]phenoxy}acetonitrile](/api/spectrum/7GBSL1OUwbO/structure.png?h=300&w=458 "{4-bromo-2-[(1,3-dimethyl-2,4,6-trioxotetrahydro-5(2H)-pyrimidinylidene)methyl]phenoxy}acetonitrile")
