| SpectraBase Spectrum ID |
820Yx1A7PGu |
| Name |
Carbonic acid, methyl 3-(trifluoromethyl)phenyl ester |
| Comments |
Computed using SmartSpectra Model v1.42 |
| Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass |
220.034728571 u |
| Formula |
C9H7F3O3 |
| InChI |
InChI=1S/C9H7F3O3/c1-14-8(13)15-7-4-2-3-6(5-7)9(10,11)12/h2-5H,1H3 |
| InChIKey |
BOIFGTBGCZKOCV-UHFFFAOYSA-N |
| Molecular Weight |
220.147 g/mol |
| SMILES |
C(OC1=CC(C(F)(F)F)=CC=C1)(OC)=O |
| Spectrum/Structure Validation Score (Vapor Phase IR) |
0.965009 |
