| SpectraBase Spectrum ID |
3cl4wAeT3cx |
| Name |
4-((E)-{[3-(3-methylphenyl)-5-sulfanyl-4H-1,2,4-triazol-4-yl]imino}methyl)phenol |
| Comments |
Computed using HOSE algorithm |
| Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass |
310.088832260 u |
| Formula |
C16H14N4OS |
| InChI |
InChI=1S/C16H14N4OS/c1-11-3-2-4-13(9-11)15-18-19-16(22)20(15)17-10-12-5-7-14(21)8-6-12/h2-10,21H,1H3,(H,19,22)/b17-10+ |
| InChIKey |
XHBYEDSGLRZRBV-LICLKQGHSA-N |
| Molecular Weight |
310.375 g/mol |
| SMILES |
SC1=NN=C(N1\N=C\C1=CC=C(C=C1)O)C1=CC(C)=CC=C1 |
![4-((E)-{[3-(3-methylphenyl)-5-sulfanyl-4H-1,2,4-triazol-4-yl]imino}methyl)phenol](/api/spectrum/3cl4wAeT3cx/structure.png?h=300&w=458 "4-((E)-{[3-(3-methylphenyl)-5-sulfanyl-4H-1,2,4-triazol-4-yl]imino}methyl)phenol")
