| SpectraBase Spectrum ID |
2i3veYZDDXQ |
| Name |
3,5-bis(Trifluoromethylsulfonyl)benzene-1,2-diol |
| Comments |
Computed using SmartSpectra Model v1.42 |
| Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass |
373.935349169 u |
| Formula |
C8H4F6O6S2 |
| InChI |
InChI=1S/C8H4F6O6S2/c9-7(10,11)21(17,18)3-1-4(15)6(16)5(2-3)22(19,20)8(12,13)14/h1-2,15-16H |
| InChIKey |
LLVHQTRLLOAMAQ-UHFFFAOYSA-N |
| Molecular Weight |
374.224 g/mol |
| SMILES |
C=1(S(C(F)(F)F)(=O)=O)C=C(S(C(F)(F)F)(=O)=O)C=C(C1O)O |
| Spectrum/Structure Validation Score (Vapor Phase IR) |
0.969365 |
