| SpectraBase Spectrum ID |
JnOLxa7Ejwn |
| Name |
2,2,3,3,4,4,4-Heptafluoro-N-(1-(3-methoxy-4-methylphenyl)-2-methylpropan-2-yl)butanamide |
| Comments |
Computed using SmartSpectra Model v1.42 |
| Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass |
389.122575963 u |
| Formula |
C16H18F7NO2 |
| InChI |
InChI=1S/C16H18F7NO2/c1-9-5-6-10(7-11(9)26-4)8-13(2,3)24-12(25)14(17,18)15(19,20)16(21,22)23/h5-7H,8H2,1-4H3,(H,24,25) |
| InChIKey |
LRECDVVGJNYGAA-UHFFFAOYSA-N |
| Molecular Weight |
389.314 g/mol |
| SMILES |
C1(=CC(=CC=C1C)CC(NC(C(F)(F)C(F)(F)C(F)(F)F)=O)(C)C)OC |
| Spectrum/Structure Validation Score (Vapor Phase IR) |
0.855357 |
