| SpectraBase Spectrum ID |
JhxVS1ABgJ7 |
| Name |
7-Methoxy-4-(trifluoromethyl)coumarin |
| Comments |
Computed using SmartSpectra Model v1.42 |
| Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass |
244.034728571 u |
| Formula |
C11H7F3O3 |
| InChI |
InChI=1S/C11H7F3O3/c1-16-6-2-3-7-8(11(12,13)14)5-10(15)17-9(7)4-6/h2-5H,1H3 |
| InChIKey |
HAZHUELNIGDYQH-UHFFFAOYSA-N |
| Molecular Weight |
244.169 g/mol |
| SMILES |
C(F)(F)(F)C1=CC(=O)OC=2C1=CC=C(C2)OC |
| Spectrum/Structure Validation Score (Vapor Phase IR) |
0.933912 |
