SpectraBase Spectrum ID |
BMJCZNHs7V6 |
Name |
alpha-Ethyl-4-fluoro-benzeneacetamide; benzeneacetaldehyde, alpha-ethyl-4-fluoro-; butyraldehyde, 2-(p-fluorophenyl)- |
Comments |
Computed using SmartSpectra Model v1.42 |
Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
Exact Mass |
166.079393136 u |
Formula |
C10H11FO |
InChI |
InChI=1S/C10H11FO/c1-2-8(7-12)9-3-5-10(11)6-4-9/h3-8H,2H2,1H3 |
InChIKey |
AUBUGOPTRPNLFG-UHFFFAOYSA-N |
Molecular Weight |
166.195 g/mol |
SMILES |
C1(=CC=C(C=C1)F)C(C=O)CC |
Spectrum/Structure Validation Score (Raman) |
0.973478 |