| SpectraBase Spectrum ID |
8xPQpA2cXEY |
| Name |
N-[1-(1,3-Benzodioxol-4-yl)propan-2-yl]-2,2,3,3,3-pentafluoro-N-methylpropanamide |
| Comments |
Computed using SmartSpectra Model v1.42 |
| Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass |
339.089384127 u |
| Formula |
C14H14F5NO3 |
| InChI |
InChI=1S/C14H14F5NO3/c1-8(20(2)12(21)13(15,16)14(17,18)19)6-9-4-3-5-10-11(9)23-7-22-10/h3-5,8H,6-7H2,1-2H3 |
| InChIKey |
NHMWIQWKXXTQLK-UHFFFAOYSA-N |
| Molecular Weight |
339.262 g/mol |
| SMILES |
C1(=CC=CC2=C1OCO2)CC(N(C(=O)C(F)(C(F)(F)F)F)C)C |
| Spectrum/Structure Validation Score (Vapor Phase IR) |
0.837416 |
![N-(1-(benzo[d][1,3]dioxol-4-yl)propan-2-yl)-2,2,3,3,3-pentafluoro-N-methylpropanamide](/api/spectrum/8xPQpA2cXEY/structure.png?h=300&w=458 "N-(1-(benzo[d][1,3]dioxol-4-yl)propan-2-yl)-2,2,3,3,3-pentafluoro-N-methylpropanamide")
