For citations & permissions, please see: Citations & Permissions - Wiley Science Solutions*

*Links on SpectraBase are not permalinks.

2-Propionylpyridine 4-[4-bromophenyl]-3-thiosemicarbazone

View entire compound with spectra: 1 FTIR

2-Propionylpyridine 4-[4-bromophenyl]-3-thiosemicarbazone
SpectraBase Compound ID KRE0ioQTQej
InChI InChI=1S/C15H15BrN4S/c1-2-13(14-5-3-4-10-17-14)19-20-15(21)18-12-8-6-11(16)7-9-12/h3-10H,2H2,1H3,(H2,18,20,21)/b19-13+
InChIKey PRRSUFOKDTXSAO-CPNJWEJPSA-N
Mol Weight 363.28 g/mol
Molecular Formula C15H15BrN4S
Exact Mass 362.020081 g/mol

Vapor Phase (Gas) Infrared Spectrum

Vapor Phase (Gas) Infrared Spectrum

View the Full Spectrum for FREE!

The full spectrum can only be viewed using a FREE account.

SpectraBase Spectrum ID 9g5UFCvT55
Name 2-Propionylpyridine 4-[4-bromophenyl]-3-thiosemicarbazone
Comments Computed using SmartSpectra Model v1.42
Copyright Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 362.020080673 u
Formula C15H15BrN4S
InChI InChI=1S/C15H15BrN4S/c1-2-13(14-5-3-4-10-17-14)19-20-15(21)18-12-8-6-11(16)7-9-12/h3-10H,2H2,1H3,(H2,18,20,21)/b19-13+
InChIKey PRRSUFOKDTXSAO-CPNJWEJPSA-N
Molecular Weight 363.277 g/mol
SMILES C1(=CC=CC=N1)\C(=N\NC(NC1=CC=C(C=C1)Br)=S)CC
Spectrum/Structure Validation Score (Vapor Phase IR) 0.882888