| SpectraBase Spectrum ID |
2DwTes1PjUu |
| Name |
N-(4-Fluorophenyl)-2-(piperazin-1-yl)acetamide |
| Comments |
Computed using SmartSpectra Model v1.42 |
| Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass |
237.127740309 u |
| Formula |
C12H16FN3O |
| InChI |
InChI=1S/C12H16FN3O/c13-10-1-3-11(4-2-10)15-12(17)9-16-7-5-14-6-8-16/h1-4,14H,5-9H2,(H,15,17) |
| InChIKey |
ICEIGLHBKQEEMG-UHFFFAOYSA-N |
| Molecular Weight |
237.278 g/mol |
| SMILES |
C1(F)=CC=C(C=C1)NC(=O)CN1CCNCC1 |
| Spectrum/Structure Validation Score (Vapor Phase IR) |
0.954045 |
