| SpectraBase Spectrum ID |
3yp6o4cNl3Q |
| Name |
Azetidine, 1-benzyl-3,3-dimethyl-2-phenyl- |
| Comments |
Computed using SmartSpectra Model v1.42 |
| Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass |
251.167399680 u |
| Formula |
C18H21N |
| InChI |
InChI=1S/C18H21N/c1-18(2)14-19(13-15-9-5-3-6-10-15)17(18)16-11-7-4-8-12-16/h3-12,17H,13-14H2,1-2H3 |
| InChIKey |
LIPMQXINDUTQPU-UHFFFAOYSA-N |
| Molecular Weight |
251.373 g/mol |
| SMILES |
C(N1C(C(C1)(C)C)C1=CC=CC=C1)C1=CC=CC=C1 |
| Spectrum/Structure Validation Score (Vapor Phase IR) |
0.925335 |
