SpectraBase Spectrum ID |
2P93oKubA2P |
Name |
3-E-Hydroxy-1,3-dimethyl-6-(4-flurophenyl)-4-piperidone |
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/c1-8-12(16)7-11(15(2)13(8)17)9-3-5-10(14)6-4-9/h3-6,8,11,13,17H,7H2,1-2H3 |
InChIKey |
ARDQZINSMHQBJE-UHFFFAOYSA-N |
Molecular Weight |
237.274 g/mol |
SMILES |
C1(N(C(CC(C1C)=O)C1=CC=C(C=C1)F)C)O |
Spectrum/Structure Validation Score (Vapor Phase IR) |
0.935347 |