| SpectraBase Spectrum ID |
3qYnChZcOF |
| Name |
5,5-Dimethyl-3-(alpha,alpha,alpha,alpha',alpha',alpha'-hexafluoro-3,5-xylyl)-2,4-oxazolidinedione |
| Comments |
Computed using SmartSpectra Model v1.42 |
| Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass |
341.048662129 u |
| Formula |
C13H9F6NO3 |
| InChI |
InChI=1S/C13H9F6NO3/c1-11(2)9(21)20(10(22)23-11)8-4-6(12(14,15)16)3-7(5-8)13(17,18)19/h3-5H,1-2H3 |
| InChIKey |
MQBWDXTWWHEKHE-UHFFFAOYSA-N |
| Molecular Weight |
341.209 g/mol |
| SMILES |
C(F)(F)(F)C1=CC(=CC(=C1)N1C(C(OC1=O)(C)C)=O)C(F)(F)F |
| Spectrum/Structure Validation Score (Raman) |
0.733527 |
