| SpectraBase Spectrum ID |
6qmmxpwGKDU |
| Name |
5-(4-Hydroxybenzyl)-3-phenyl-2-thiohydantoin |
| Comments |
Computed using SmartSpectra Model v1.42 |
| Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass |
298.077598871 u |
| Formula |
C16H14N2O2S |
| InChI |
InChI=1S/C16H14N2O2S/c19-13-8-6-11(7-9-13)10-14-15(20)18(16(21)17-14)12-4-2-1-3-5-12/h1-9,14,19H,10H2,(H,17,21) |
| InChIKey |
LCFDDJINTNHAEQ-UHFFFAOYSA-N |
| Molecular Weight |
298.360 g/mol |
| Nominal Mass |
298 u |
| SMILES |
C1(=S)NC(C(N1C1=CC=CC=C1)=O)CC1=CC=C(C=C1)O |
| Spectrum/Structure Validation Score (Vapor Phase IR) |
0.896931 |
