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

*Links on SpectraBase are not permalinks.

6-Bromo-4'-chlorothioflavone

View entire compound with spectra: 1 FTIR

6-Bromo-4'-chlorothioflavone
SpectraBase Compound ID 4vZk4j2VYDb
InChI InChI=1S/C15H8BrClOS/c16-10-3-6-14-12(7-10)13(18)8-15(19-14)9-1-4-11(17)5-2-9/h1-8H
InChIKey XGRSYKYXJAXRNM-UHFFFAOYSA-N
Mol Weight 351.65 g/mol
Molecular Formula C15H8BrClOS
Exact Mass 349.916777 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 8JkQYjObcVZ
Name 6-Bromo-4'-chlorothioflavone
Comments Computed using SmartSpectra Model v1.42
Copyright Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 349.916776751 u
Formula C15H8BrClOS
InChI InChI=1S/C15H8BrClOS/c16-10-3-6-14-12(7-10)13(18)8-15(19-14)9-1-4-11(17)5-2-9/h1-8H
InChIKey XGRSYKYXJAXRNM-UHFFFAOYSA-N
Molecular Weight 351.645 g/mol
SMILES C12=C(C(C=C(S2)C2=CC=C(C=C2)Cl)=O)C=C(C=C1)Br
Spectrum/Structure Validation Score (Vapor Phase IR) 0.93106