SpectraBase Spectrum ID |
1SeJ4AN5bxF |
Name |
2-Propanamine, N-(2,2-dichloro-3-phenylpropylidene)-2-methyl- |
Comments |
Computed using SmartSpectra Model v1.42 |
Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
Exact Mass |
257.073804951 u |
Formula |
C13H17Cl2N |
InChI |
InChI=1S/C13H17Cl2N/c1-12(2,3)16-10-13(14,15)9-11-7-5-4-6-8-11/h4-8,10H,9H2,1-3H3/b16-10+ |
InChIKey |
GCUHANWCDSLMRX-MHWRWJLKSA-N |
Molecular Weight |
258.192 g/mol |
SMILES |
C(\C=N\C(C)(C)C)(CC=1C=CC=CC1)(Cl)Cl |
Spectrum/Structure Validation Score (Vapor Phase IR) |
0.909003 |