| SpectraBase Spectrum ID |
64zvJWWD9Ak |
| Name |
2,4-Dinitro-4'-methyksulfonyldiphenylsulfoxide |
| Comments |
Computed using SmartSpectra Model v1.42 |
| Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass |
369.992943011 u |
| Formula |
C13H10N2O7S2 |
| InChI |
InChI=1S/C13H10N2O7S2/c1-24(21,22)11-5-3-10(4-6-11)23(20)13-7-2-9(14(16)17)8-12(13)15(18)19/h2-8H,1H3 |
| InChIKey |
OGWSBRPTODAFCL-UHFFFAOYSA-N |
| Molecular Weight |
370.350 g/mol |
| SMILES |
C1=C(C(=CC(=C1)N(=O)=O)N(=O)=O)S(=O)C1=CC=C(C=C1)S(=O)(=O)C |
| Spectrum/Structure Validation Score (Vapor Phase IR) |
0.942689 |
