SpectraBase Spectrum ID |
4g8JmLqYUkk |
Name |
N-(p-Methylbenzylidene)-2,3-xylidine |
Comments |
Computed using SmartSpectra Model v1.42 |
Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
Exact Mass |
223.136099551 u |
Formula |
C16H17N |
InChI |
InChI=1S/C16H17N/c1-12-7-9-15(10-8-12)11-17-16-6-4-5-13(2)14(16)3/h4-11H,1-3H3/b17-11+ |
InChIKey |
ZYRJUEUZWSPWMM-GZTJUZNOSA-N |
Molecular Weight |
223.319 g/mol |
SMILES |
C=1C=CC(=C(C1C)C)\N=C\C=1C=CC(=CC1)C |
Spectrum/Structure Validation Score (Raman) |
0.730435 |