| SpectraBase Spectrum ID |
DcVsuUalXQD |
| Name |
3-Benzyl-6-oxa-3-azabicyclo[3.1.0]hexan-2-one |
| Comments |
Computed using SmartSpectra Model v1.42 |
| Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass |
189.078978596 u |
| Formula |
C11H11NO2 |
| InChI |
InChI=1S/C11H11NO2/c13-11-10-9(14-10)7-12(11)6-8-4-2-1-3-5-8/h1-5,9-10H,6-7H2 |
| InChIKey |
ICWTYPGBCUZNMP-UHFFFAOYSA-N |
| Molecular Weight |
189.214 g/mol |
| SMILES |
C12C(CN(C2=O)CC=2C=CC=CC2)O1 |
| Spectrum/Structure Validation Score (Vapor Phase IR) |
0.961969 |
![3-Benzyl-6-oxa-3-azabicyclo[3.1.0]hexan-2-one](/api/spectrum/DcVsuUalXQD/structure.png?h=300&w=458 "3-Benzyl-6-oxa-3-azabicyclo[3.1.0]hexan-2-one")
