| SpectraBase Spectrum ID |
G8exM4q0LsY |
| Name |
4-(4-Azanyl-3-bromanyl-phenyl)sulfonyl-2-bromanyl-aniline |
| Comments |
Computed using SmartSpectra Model v1.42 |
| Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass |
403.882974742 u |
| Formula |
C12H10Br2N2O2S |
| InChI |
InChI=1S/C12H10Br2N2O2S/c13-9-5-7(1-3-11(9)15)19(17,18)8-2-4-12(16)10(14)6-8/h1-6H,15-16H2 |
| InChIKey |
IQPNAQCIBYLLGN-UHFFFAOYSA-N |
| Molecular Weight |
406.092 g/mol |
| SMILES |
C=1(S(=O)(=O)C=2C=C(C(=CC2)N)Br)C=C(C(=CC1)N)Br |
| Spectrum/Structure Validation Score (Vapor Phase IR) |
0.922456 |
