SpectraBase Spectrum ID |
K542eaYhQhw |
Name |
Furane-2(3H)-thione, 3-dimethylaminomethylene-5-phenyl- |
Comments |
Computed using SmartSpectra Model v1.42 |
Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
Exact Mass |
231.071785216 u |
Formula |
C13H13NOS |
InChI |
InChI=1S/C13H13NOS/c1-14(2)9-11-8-12(15-13(11)16)10-6-4-3-5-7-10/h3-9H,1-2H3/b11-9- |
InChIKey |
NHFINFWNFIOYBG-LUAWRHEFSA-N |
Molecular Weight |
231.313 g/mol |
SMILES |
C1(\C(C=C(O1)C=1C=CC=CC1)=C/N(C)C)=S |
Spectrum/Structure Validation Score (Vapor Phase IR) |
0.937445 |