| SpectraBase Spectrum ID |
9LRUlOEtDLH |
| Name |
3,4-Dimethoxymethcathinone, N-pentafluoropropionyl- |
| Comments |
Computed using SmartSpectra Model v1.42 |
| Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass |
369.099948810 u |
| Formula |
C15H16F5NO4 |
| InChI |
InChI=1S/C15H16F5NO4/c1-8(21(2)13(23)14(16,17)15(18,19)20)12(22)9-5-6-10(24-3)11(7-9)25-4/h5-8H,1-4H3 |
| InChIKey |
WBVWSJHNZGLBNQ-UHFFFAOYSA-N |
| Molecular Weight |
369.288 g/mol |
| SMILES |
C(C(N(C)C(C(C(F)(F)F)(F)F)=O)C)(=O)C1=CC(OC)=C(C=C1)OC |
| Spectrum/Structure Validation Score (Vapor Phase IR) |
0.896448 |
