| SpectraBase Spectrum ID |
5gu6nSw1zp2 |
| Name |
4H-Chromene-3-carboxylic acid, 6,7,8-trifluoro-2-methyl-4-oxo-, (4-methoxyphenyl)amide |
| Comments |
Computed using SmartSpectra Model v1.42 |
| Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass |
363.071842355 u |
| Formula |
C18H12F3NO4 |
| InChI |
InChI=1S/C18H12F3NO4/c1-8-13(18(24)22-9-3-5-10(25-2)6-4-9)16(23)11-7-12(19)14(20)15(21)17(11)26-8/h3-7H,1-2H3,(H,22,24) |
| InChIKey |
ISUUQAGROZOPAY-UHFFFAOYSA-N |
| Molecular Weight |
363.292 g/mol |
| SMILES |
C1(=C(C(=C2C(=C1)C(=O)C(C(NC=1C=CC(OC)=CC1)=O)=C(O2)C)F)F)F |
| Spectrum/Structure Validation Score (Vapor Phase IR) |
0.938581 |
