| SpectraBase Spectrum ID |
9O98VNMH6wI |
| Name |
5-Bromo-3-[N-(4-fluorophenyl)thiosemicarbazono]-1H-2-indolinone |
| Comments |
Computed using SmartSpectra Model v1.42 |
| Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass |
391.974273294 u |
| Formula |
C15H10BrFN4OS |
| InChI |
InChI=1S/C15H10BrFN4OS/c16-8-1-6-12-11(7-8)13(14(22)19-12)20-21-15(23)18-10-4-2-9(17)3-5-10/h1-7H,(H2,18,21,23)(H,19,20,22) |
| InChIKey |
NWPIFOWAOAFYDL-UHFFFAOYSA-N |
| Molecular Weight |
393.234 g/mol |
| SMILES |
C1(Br)=CC=C2NC(\C(C2=C1)=N/NC(=S)NC1=CC=C(C=C1)F)=O |
| Spectrum/Structure Validation Score (Vapor Phase IR) |
0.844758 |
![5-Bromo-3-[N-(4-fluorophenyl)thiosemicarbazono]-1H-2-indolinone](/api/spectrum/9O98VNMH6wI/structure.png?h=300&w=458 "5-Bromo-3-[N-(4-fluorophenyl)thiosemicarbazono]-1H-2-indolinone")
