SpectraBase Spectrum ID |
LaALUkeegeS |
Name |
N-(1,1-Dimethyl-2-phenylethyl)-2,2-dimethyl-3-phenylaziridine-1-carboxamide |
Comments |
Computed using SmartSpectra Model v1.42 |
Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
Exact Mass |
322.204513464 u |
Formula |
C21H26N2O |
InChI |
InChI=1S/C21H26N2O/c1-20(2,15-16-11-7-5-8-12-16)22-19(24)23-18(21(23,3)4)17-13-9-6-10-14-17/h5-14,18H,15H2,1-4H3,(H,22,24) |
InChIKey |
PWOXPMOFYRXRHH-UHFFFAOYSA-N |
Molecular Weight |
322.452 g/mol |
SMILES |
C(C(NC(N1C(C)(C)C1C1=CC=CC=C1)=O)(C)C)C1=CC=CC=C1 |
Spectrum/Structure Validation Score (Vapor Phase IR) |
0.963749 |