| SpectraBase Spectrum ID |
2I4RM5iYGP3 |
| Name |
2-Bromo-N-cyclopentyl-5-fluorobenzamide |
| Comments |
Computed using SmartSpectra Model v1.42 |
| Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass |
285.016455205 u |
| Formula |
C12H13BrFNO |
| InChI |
InChI=1S/C12H13BrFNO/c13-11-6-5-8(14)7-10(11)12(16)15-9-3-1-2-4-9/h5-7,9H,1-4H2,(H,15,16) |
| InChIKey |
UKMTXJQZOJZPKM-UHFFFAOYSA-N |
| Molecular Weight |
286.144 g/mol |
| SMILES |
C1(F)=CC(=C(C=C1)Br)C(=O)NC1CCCC1 |
| Spectrum/Structure Validation Score (Vapor Phase IR) |
0.867615 |
