| SpectraBase Spectrum ID |
9Y1qaae1M3m |
| Name |
Succinic acid, 1,1,1-trifluoroprop-2-yl 2-methylphenyl ester |
| Comments |
Computed using SmartSpectra Model v1.42 |
| Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass |
304.092243448 u |
| Formula |
C14H15F3O4 |
| InChI |
InChI=1S/C14H15F3O4/c1-9-5-3-4-6-11(9)21-13(19)8-7-12(18)20-10(2)14(15,16)17/h3-6,10H,7-8H2,1-2H3 |
| InChIKey |
MZFBFCAKLFZHKB-UHFFFAOYSA-N |
| Molecular Weight |
304.265 g/mol |
| SMILES |
C(CC(OC(C)C(F)(F)F)=O)C(OC=1C(C)=CC=CC1)=O |
| Spectrum/Structure Validation Score (Vapor Phase IR) |
0.97 |
