SpectraBase Spectrum ID |
D3UhoxcKEOm |
Name |
Fipexide |
Comments |
Computed using SmartSpectra Model v1.42 |
Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
Exact Mass |
388.118984860 u |
Formula |
C20H21ClN2O4 |
InChI |
InChI=1S/C20H21ClN2O4/c21-16-2-4-17(5-3-16)25-13-20(24)23-9-7-22(8-10-23)12-15-1-6-18-19(11-15)27-14-26-18/h1-6,11H,7-10,12-14H2 |
InChIKey |
BFUJHVVEMMWLHC-UHFFFAOYSA-N |
Molecular Weight |
388.851 g/mol |
SMILES |
C1CN(CCN1CC=1C=C2OCOC2=CC1)C(COC=1C=CC(=CC1)Cl)=O |
Spectrum/Structure Validation Score (Raman) |
0.913749 |