SpectraBase Spectrum ID |
K070D6XvtCC |
Name |
1-[2-Acetylpyridine]-4-[3-methylphenyl]-3-thiosemicarbazone |
Comments |
Computed using SmartSpectra Model v1.42 |
Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
Exact Mass |
284.109567705 u |
Formula |
C15H16N4S |
InChI |
InChI=1S/C15H16N4S/c1-11-6-5-7-13(10-11)17-15(20)19-18-12(2)14-8-3-4-9-16-14/h3-10H,1-2H3,(H2,17,19,20)/b18-12+ |
InChIKey |
ANJKHGQGRYJRCY-LDADJPATSA-N |
Molecular Weight |
284.381 g/mol |
SMILES |
C(N\N=C\(C=1C=CC=CN1)C)(NC1=CC=CC(=C1)C)=S |
Spectrum/Structure Validation Score (Vapor Phase IR) |
0.936983 |