| SpectraBase Compound ID | 2L1srRoi1b2 |
|---|---|
| InChI | InChI=1S/C13H17F2NO2/c1-2-3-7-16-8-6-10-4-5-11-12(9-10)18-13(14,15)17-11/h4-5,9,16H,2-3,6-8H2,1H3 |
| InChIKey | PCJACMUBIVYKAA-UHFFFAOYSA-N |
| Mol Weight | 257.28 g/mol |
| Molecular Formula | C13H17F2NO2 |
| Exact Mass | 257.122735 g/mol |
Vapor Phase (Gas) Infrared Spectrum
Subscribe to view the full spectrum.
The full spectrum can only be viewed using a FREE account.
| SpectraBase Spectrum ID | 8ejdaIuVjLf |
|---|---|
| Name | Dfmdpea bu |
| Comments | Computed using SmartSpectra Model v1.42 |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 257.122735115 u |
| Formula | C13H17F2NO2 |
| InChI | InChI=1S/C13H17F2NO2/c1-2-3-7-16-8-6-10-4-5-11-12(9-10)18-13(14,15)17-11/h4-5,9,16H,2-3,6-8H2,1H3 |
| InChIKey | PCJACMUBIVYKAA-UHFFFAOYSA-N |
| Molecular Weight | 257.281 g/mol |
| SMILES | C1(OC=2C(O1)=CC(=CC2)CCNCCCC)(F)F |
| Spectrum/Structure Validation Score (Vapor Phase IR) | 0.934908 |