SpectraBase Spectrum ID |
K45UjNfs4GP |
Name |
Aziridine, 3-methyl-2-(2-methylpropyl)-2-phenyl-, trans- |
Comments |
Computed using SmartSpectra Model v1.42 |
Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
Exact Mass |
189.151749616 u |
Formula |
C13H19N |
InChI |
InChI=1S/C13H19N/c1-10(2)9-13(11(3)14-13)12-7-5-4-6-8-12/h4-8,10-11,14H,9H2,1-3H3 |
InChIKey |
IBAZAPAXHUCKDB-UHFFFAOYSA-N |
Molecular Weight |
189.302 g/mol |
SMILES |
C1(NC1C)(CC(C)C)C=1C=CC=CC1 |
Spectrum/Structure Validation Score (Vapor Phase IR) |
0.945114 |