| SpectraBase Spectrum ID |
81sKu6l3jLB |
| Name |
Methyl 6-[2-(benzyloxy)-4-fluorophenyl]-5-oxo-1,2,3,5-tetrahydroindolizine-8-carboxylate |
| Comments |
Computed using SmartSpectra Model v1.42 |
| Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass |
393.137636287 u |
| Formula |
C23H20FNO4 |
| InChI |
InChI=1S/C23H20FNO4/c1-28-23(27)19-13-18(22(26)25-11-5-8-20(19)25)17-10-9-16(24)12-21(17)29-14-15-6-3-2-4-7-15/h2-4,6-7,9-10,12-13H,5,8,11,14H2,1H3 |
| InChIKey |
PPKWMBIAGPTLET-UHFFFAOYSA-N |
| Molecular Weight |
393.414 g/mol |
| SMILES |
C1CCN2C1=C(C=C(C2=O)C1=C(C=C(C=C1)F)OCC1=CC=CC=C1)C(=O)OC |
| Spectrum/Structure Validation Score (Vapor Phase IR) |
0.868735 |
![Methyl 6-[2-(benzyloxy)-4-fluorophenyl]-5-oxo-1,2,3,5-tetrahydroindolizine-8-carboxylate](/api/spectrum/81sKu6l3jLB/structure.png?h=300&w=458 "Methyl 6-[2-(benzyloxy)-4-fluorophenyl]-5-oxo-1,2,3,5-tetrahydroindolizine-8-carboxylate")
