| SpectraBase Spectrum ID |
HmaoyesPuE7 |
| Name |
Benzofurane-7-carboxamide, 2,3-dihydro-5-bromo-N-(3-trifluoromethylphenyl)- |
| Comments |
Computed using SmartSpectra Model v1.42 |
| Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass |
384.992526085 u |
| Formula |
C16H11BrF3NO2 |
| InChI |
InChI=1S/C16H11BrF3NO2/c17-11-6-9-4-5-23-14(9)13(8-11)15(22)21-12-3-1-2-10(7-12)16(18,19)20/h1-3,6-8H,4-5H2,(H,21,22) |
| InChIKey |
VLBMGRVJPFHCMB-UHFFFAOYSA-N |
| Molecular Weight |
386.168 g/mol |
| SMILES |
C1(C(NC2=CC=CC(C(F)(F)F)=C2)=O)=C2C(CCO2)=CC(=C1)Br |
| Spectrum/Structure Validation Score (Vapor Phase IR) |
0.922521 |
