SpectraBase Spectrum ID |
KEf0ASluxD4 |
Name |
5-Chloro-2,4-dimethoxy-N-piperonylideneaniline |
Comments |
Computed using SmartSpectra Model v1.42 |
Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
Exact Mass |
319.061135631 u |
Formula |
C16H14ClNO4 |
InChI |
InChI=1S/C16H14ClNO4/c1-19-14-7-15(20-2)12(6-11(14)17)18-8-10-3-4-13-16(5-10)22-9-21-13/h3-8H,9H2,1-2H3/b18-8+ |
InChIKey |
WERHNGROOIVTDA-QGMBQPNBSA-N |
Molecular Weight |
319.744 g/mol |
SMILES |
C=1C(=C(C=C(C1Cl)OC)OC)\N=C\C=1C=CC=2OCOC2C1 |
Spectrum/Structure Validation Score (Raman) |
0.925676 |