| SpectraBase Spectrum ID |
5RfPoymbc1c |
| Name |
Methyl 5-oxo-6-(4-phenoxyphenyl)-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 |
361.131408092 u |
| Formula |
C22H19NO4 |
| InChI |
InChI=1S/C22H19NO4/c1-26-22(25)19-14-18(21(24)23-13-5-8-20(19)23)15-9-11-17(12-10-15)27-16-6-3-2-4-7-16/h2-4,6-7,9-12,14H,5,8,13H2,1H3 |
| InChIKey |
NNIYPRZWUXPMRY-UHFFFAOYSA-N |
| Molecular Weight |
361.397 g/mol |
| SMILES |
C1CCN2C1=C(C=C(C2=O)C1=CC=C(C=C1)OC1=CC=CC=C1)C(=O)OC |
| Spectrum/Structure Validation Score (Vapor Phase IR) |
0.940835 |
