SpectraBase Spectrum ID |
KmIO359EscX |
Name |
2-(2-[(4-Chlorophenyl)imino]-4-(3-fluoro-4-methoxyphenyl)-1,3-thiazol-3(2H)-yl)ethanol |
Comments |
Computed using SmartSpectra Model v1.42 |
Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
Exact Mass |
378.060504798 u |
Formula |
C18H16ClFN2O2S |
InChI |
InChI=1S/C18H16ClFN2O2S/c1-24-17-7-2-12(10-15(17)20)16-11-25-18(22(16)8-9-23)21-14-5-3-13(19)4-6-14/h2-7,10-11,23H,8-9H2,1H3/b21-18- |
InChIKey |
DJCQQCNLMJBRGH-UZYVYHOESA-N |
Molecular Weight |
378.849 g/mol |
SMILES |
C=1(N(\C(SC1)=N\C1=CC=C(C=C1)Cl)CCO)C=1C=C(F)C(=CC1)OC |
Spectrum/Structure Validation Score (Vapor Phase IR) |
0.868822 |