| SpectraBase Spectrum ID |
EPiA1ZsvzUp |
| Name |
Durene-.alpha.1,.alpha.2-dithiol, S,S'-bis(pentafluoropropionyl)- |
| Comments |
Computed using SmartSpectra Model v1.42 |
| Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass |
490.011903602 u |
| Formula |
C16H12F10O2S2 |
| InChI |
InChI=1S/C16H12F10O2S2/c1-7-3-9(5-29-11(27)13(17,18)15(21,22)23)10(4-8(7)2)6-30-12(28)14(19,20)16(24,25)26/h3-4H,5-6H2,1-2H3 |
| InChIKey |
UPBIGGAJIJQABP-UHFFFAOYSA-N |
| Molecular Weight |
490.374 g/mol |
| SMILES |
C(SC(C(C(F)(F)F)(F)F)=O)C1=C(C=C(C(=C1)C)C)CSC(C(C(F)(F)F)(F)F)=O |
| Spectrum/Structure Validation Score (Vapor Phase IR) |
0.915504 |
