| SpectraBase Spectrum ID |
Lf3YFc5XsCA |
| Name |
Benzoic acid, (4-fluorophenyl)methyl ester |
| Comments |
Computed using SmartSpectra Model v1.42 |
| Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass |
230.074307755 u |
| Formula |
C14H11FO2 |
| InChI |
InChI=1S/C14H11FO2/c15-13-8-6-11(7-9-13)10-17-14(16)12-4-2-1-3-5-12/h1-9H,10H2 |
| InChIKey |
DVTATUAZGVHURR-UHFFFAOYSA-N |
| Molecular Weight |
230.238 g/mol |
| SMILES |
C1(=CC=C(C=C1)COC(C1=CC=CC=C1)=O)F |
| Spectrum/Structure Validation Score (Vapor Phase IR) |
0.93857 |
