| SpectraBase Spectrum ID |
AII5mkCBATJ |
| Name |
6-Benzyl-3-methoxy-1-phenyl-1,5,6,7-tetrahydro-2H-pyrrolo[3,4-B]pyridin-2-one |
| Comments |
Computed using SmartSpectra Model v1.42 |
| Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass |
332.152477890 u |
| Formula |
C21H20N2O2 |
| InChI |
InChI=1S/C21H20N2O2/c1-25-20-12-17-14-22(13-16-8-4-2-5-9-16)15-19(17)23(21(20)24)18-10-6-3-7-11-18/h2-12H,13-15H2,1H3 |
| InChIKey |
TXCQAXNMNSEJJO-UHFFFAOYSA-N |
| Molecular Weight |
332.403 g/mol |
| SMILES |
C1=2N(C(=O)C(=CC2CN(C1)CC=1C=CC=CC1)OC)C1=CC=CC=C1 |
| Spectrum/Structure Validation Score (Vapor Phase IR) |
0.882034 |
![6-Benzyl-3-methoxy-1-phenyl-1,5,6,7-tetrahydro-2H-pyrrolo[3,4-b]pyridin-2-one](/api/spectrum/AII5mkCBATJ/structure.png?h=300&w=458 "6-Benzyl-3-methoxy-1-phenyl-1,5,6,7-tetrahydro-2H-pyrrolo[3,4-b]pyridin-2-one")
