| SpectraBase Spectrum ID |
8jb9r4QkCZ8 |
| Name |
3-Methylene-5-phenyl-4-(phenylsulfonyl)-1-azabicyclo[3.1.0]hexane |
| Comments |
Computed using SmartSpectra Model v1.42 |
| Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass |
311.097999963 u |
| Formula |
C18H17NO2S |
| InChI |
InChI=1S/C18H17NO2S/c1-14-12-19-13-18(19,15-8-4-2-5-9-15)17(14)22(20,21)16-10-6-3-7-11-16/h2-11,17H,1,12-13H2 |
| InChIKey |
ALMNDGMVXNKBRE-UHFFFAOYSA-N |
| Molecular Weight |
311.399 g/mol |
| SMILES |
C1N2C(C(C1=C)S(=O)(=O)C=1C=CC=CC1)(C2)C=1C=CC=CC1 |
| Spectrum/Structure Validation Score (Vapor Phase IR) |
0.877645 |
![3-Methylene-5-phenyl-4-(phenylsulfonyl)-1-azabicyclo[3.1.0]hexane](/api/spectrum/8jb9r4QkCZ8/structure.png?h=300&w=458 "3-Methylene-5-phenyl-4-(phenylsulfonyl)-1-azabicyclo[3.1.0]hexane")
