| SpectraBase Spectrum ID |
KbTdtqA7485 |
| Name |
2-[((2Z)-3,5-diphenyl-1,3,4-thiadiazol-2(3H)-ylidene)amino]ethyl hydrosulfide |
| Comments |
Computed using SmartSpectra Model v1.42 |
| Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass |
313.070739843 u |
| Formula |
C16H15N3S2 |
| InChI |
InChI=1S/C16H15N3S2/c20-12-11-17-16-19(14-9-5-2-6-10-14)18-15(21-16)13-7-3-1-4-8-13/h1-10,20H,11-12H2/b17-16- |
| InChIKey |
AUHYYKXSTAGALJ-MSUUIHNZSA-N |
| Molecular Weight |
313.437 g/mol |
| SMILES |
C1=CC=C(C=2S\C(N(N2)C=2C=CC=CC2)=N/CCS)C=C1 |
| Spectrum/Structure Validation Score (Vapor Phase IR) |
0.807073 |