SpectraBase Spectrum ID |
6qDjS4u2ps8 |
Name |
(4-Chloro-2,5-dimethoxy-phenyl)-[3-ethyl-4-(4-fluoro-phenyl)-3H-thiazol-2-ylidene]-amine |
Comments |
Computed using SmartSpectra Model v1.42 |
Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
Exact Mass |
392.076154863 u |
Formula |
C19H18ClFN2O2S |
InChI |
InChI=1S/C19H18ClFN2O2S/c1-4-23-16(12-5-7-13(21)8-6-12)11-26-19(23)22-15-10-17(24-2)14(20)9-18(15)25-3/h5-11H,4H2,1-3H3/b22-19+ |
InChIKey |
RDNKZXHTZDIARY-ZBJSNUHESA-N |
Molecular Weight |
392.876 g/mol |
SMILES |
C=1(N(\C(SC1)=N/C=1C=C(OC)C(=CC1OC)Cl)CC)C=1C=CC(=CC1)F |
Spectrum/Structure Validation Score (Vapor Phase IR) |
0.903309 |