SpectraBase Spectrum ID |
KDZRyCLezlS |
Name |
1-(4-Fluorophenyl)-3-morpholino-propan-1-one |
Comments |
Computed using SmartSpectra Model v1.42 |
Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
Exact Mass |
237.116506920 u |
Formula |
C13H16FNO2 |
InChI |
InChI=1S/C13H16FNO2/c14-12-3-1-11(2-4-12)13(16)5-6-15-7-9-17-10-8-15/h1-4H,5-10H2 |
InChIKey |
ZLGPSAUGCOHPGC-UHFFFAOYSA-N |
Molecular Weight |
237.274 g/mol |
SMILES |
C(CCN1CCOCC1)(=O)C1=CC=C(C=C1)F |
Spectrum/Structure Validation Score (Vapor Phase IR) |
0.804477 |