| SpectraBase Spectrum ID |
C99ocJNodDp |
| Name |
alpha,alpha,alpha-Trifluoro-3,4,5-trimethoxy-m-benzotoluidide |
| Comments |
Computed using SmartSpectra Model v1.42 |
| Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass |
355.103142484 u |
| Formula |
C17H16F3NO4 |
| InChI |
InChI=1S/C17H16F3NO4/c1-23-13-7-10(8-14(24-2)15(13)25-3)16(22)21-12-6-4-5-11(9-12)17(18,19)20/h4-9H,1-3H3,(H,21,22) |
| InChIKey |
OUGMXIDDVMFDMZ-UHFFFAOYSA-N |
| Molecular Weight |
355.313 g/mol |
| SMILES |
N(C1=CC=CC(=C1)C(F)(F)F)C(C=1C=C(C(=C(C1)OC)OC)OC)=O |
| Spectrum/Structure Validation Score (Raman) |
0.918872 |
