SpectraBase Spectrum ID |
DUuhDerX32F |
Name |
Benzenamine, 3,5-bis(phenylthio)- |
Comments |
Computed using SmartSpectra Model v1.42 |
Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
Exact Mass |
309.064591835 u |
Formula |
C18H15NS2 |
InChI |
InChI=1S/C18H15NS2/c19-14-11-17(20-15-7-3-1-4-8-15)13-18(12-14)21-16-9-5-2-6-10-16/h1-13H,19H2 |
InChIKey |
KYOCVHUMALHRJT-UHFFFAOYSA-N |
Molecular Weight |
309.445 g/mol |
SMILES |
C1(=CC(SC2=CC=CC=C2)=CC(=C1)N)SC=1C=CC=CC1 |
Spectrum/Structure Validation Score (Vapor Phase IR) |
0.897249 |