| SpectraBase Spectrum ID |
CsGwqTYAAiZ |
| Name |
1-Benzoyl-5-fluorouracil |
| Comments |
Computed using SmartSpectra Model v1.42 |
| Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass |
234.044070253 u |
| Formula |
C11H7FN2O3 |
| InChI |
InChI=1S/C11H7FN2O3/c12-8-6-14(11(17)13-9(8)15)10(16)7-4-2-1-3-5-7/h1-6H,(H,13,15,17) |
| InChIKey |
RQNLYAYTZCUHLO-UHFFFAOYSA-N |
| Molecular Weight |
234.186 g/mol |
| SMILES |
C1(N(C=C(C(N1)=O)F)C(C1=CC=CC=C1)=O)=O |
| Spectrum/Structure Validation Score (Vapor Phase IR) |
0.954447 |
