| SpectraBase Spectrum ID |
H3otRJRyPir |
| Name |
4-(3,4-Dimethoxy-phenyl)-1-(4-fluoro-phenyl)-3-(4-methoxy-phenoxy)-azetidin-2-one |
| Comments |
Computed using SmartSpectra Model v1.42 |
| Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass |
423.148200970 u |
| Formula |
C24H22FNO5 |
| InChI |
InChI=1S/C24H22FNO5/c1-28-18-9-11-19(12-10-18)31-23-22(15-4-13-20(29-2)21(14-15)30-3)26(24(23)27)17-7-5-16(25)6-8-17/h4-14,22-23H,1-3H3 |
| InChIKey |
AXOIHXKCXIFERC-UHFFFAOYSA-N |
| Molecular Weight |
423.440 g/mol |
| SMILES |
COC=1C=CC(OC2C(N(C2C=2C=C(C(OC)=CC2)OC)C2=CC=C(C=C2)F)=O)=CC1 |
| Spectrum/Structure Validation Score (Vapor Phase IR) |
0.953966 |
