SpectraBase Spectrum ID |
uuJKh5QLnI |
Name |
[2-[(4-Fluorophenyl)imino]-4-methyl-1,3-thiazolan-4-yl]methanol |
Comments |
Computed using SmartSpectra Model v1.42 |
Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
Exact Mass |
240.073262383 u |
Formula |
C11H13FN2OS |
InChI |
InChI=1S/C11H13FN2OS/c1-11(6-15)7-16-10(14-11)13-9-4-2-8(12)3-5-9/h2-5,15H,6-7H2,1H3,(H,13,14) |
InChIKey |
VIZDWDRPPGVAJO-UHFFFAOYSA-N |
Molecular Weight |
240.296 g/mol |
SMILES |
C1(N\C(SC1)=N/C=1C=CC(=CC1)F)(C)CO |
Spectrum/Structure Validation Score (Vapor Phase IR) |
0.942835 |