| SpectraBase Spectrum ID |
2F878CnmLo |
| Name |
4-Bromo-3-(4-fluorophenyl)-1-(4-toluenesulfonyl)-1H-indole |
| Appearance |
White crystalline solid |
| Copyright |
Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass |
442.999091062 u |
| Formula |
C21H15BrFNO2S |
| InChI |
InChI=1S/C21H15BrFNO2S/c1-14-5-11-17(12-6-14)27(25,26)24-13-18(15-7-9-16(23)10-8-15)21-19(22)3-2-4-20(21)24/h2-13H,1H3 |
| InChIKey |
YKQYGLFOAMNUPQ-UHFFFAOYSA-N |
| Instrument Name |
ThermoElectron MAT 900 |
| Ionization Type |
EI positive ion |
| Literature Reference DOI |
10.1002/chem.201602893 |
| Molecular Weight |
444.318 g/mol |
| Reported Formula |
C21H15O2N(79)BrF(32)S |
| SMILES |
C1=C(C2=C(C=C1)N(C=C2C1=CC=C(C=C1)F)S(C1=CC=C(C=C1)C)(=O)=O)Br |
| SPLASH |
splash10-000f-0090500000-53873a47d1edbbfc3341 |
| Source of Spectrum |
QE-22-SM86-16g (DOI: 10.1002/chem.201602893) |
| Wiley ID |
1905036 |
