SpectraBase Spectrum ID |
4nbTvMGXjVy |
Name |
N-(1'-Phenylpropylidene)-2-chloroethylamine |
Comments |
Computed using SmartSpectra Model v1.42 |
Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
Exact Mass |
195.081477155 u |
Formula |
C11H14ClN |
InChI |
InChI=1S/C11H14ClN/c1-2-11(13-9-8-12)10-6-4-3-5-7-10/h3-7H,2,8-9H2,1H3/b13-11- |
InChIKey |
JRKINGQACTYEJQ-QBFSEMIESA-N |
Molecular Weight |
195.693 g/mol |
SMILES |
C(\N=C/(C=1C=CC=CC1)CC)CCl |
Spectrum/Structure Validation Score (Vapor Phase IR) |
0.913416 |