| SpectraBase Spectrum ID |
ARIiDRYmAKe |
| Name |
Phenoxyethanol-pentafluorobenzoyl ester |
| Comments |
Computed using SmartSpectra Model v1.42 |
| Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass |
332.047184962 u |
| Formula |
C15H9F5O3 |
| InChI |
InChI=1S/C15H9F5O3/c16-10-9(11(17)13(19)14(20)12(10)18)15(21)23-7-6-22-8-4-2-1-3-5-8/h1-5H,6-7H2 |
| InChIKey |
NVRDROJGVXSHRY-UHFFFAOYSA-N |
| Molecular Weight |
332.226 g/mol |
| SMILES |
C=1(C(=C(C(=C(C1F)F)F)F)F)C(OCCOC=1C=CC=CC1)=O |
| Spectrum/Structure Validation Score (Vapor Phase IR) |
0.80751 |
