SpectraBase Spectrum ID |
1x56ntpzrd8 |
Name |
Phenylacetamide, 4-fluoro-N-hexyl- |
Comments |
Computed using SmartSpectra Model v1.42 |
Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
Exact Mass |
237.152892430 u |
Formula |
C14H20FNO |
InChI |
InChI=1S/C14H20FNO/c1-2-3-4-5-10-16-14(17)11-12-6-8-13(15)9-7-12/h6-9H,2-5,10-11H2,1H3,(H,16,17) |
InChIKey |
BJHBALSPSONHSN-UHFFFAOYSA-N |
Molecular Weight |
237.318 g/mol |
SMILES |
C(C(NCCCCCC)=O)C=1C=CC(=CC1)F |
Spectrum/Structure Validation Score (Vapor Phase IR) |
0.857923 |