| SpectraBase Spectrum ID |
C6AQAd8mNg0 |
| Name |
exo,exo-4,8-Etheno-1,1,3,3,5,5,7,7-octafluoro-2,6-dioxaperhydro-S-indacene |
| Comments |
Computed using SmartSpectra Model v1.42 |
| Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass |
336.039654800 u |
| Formula |
C12H8F8O2 |
| InChI |
InChI=1S/C12H8F8O2/c13-9(14)5-3-1-2-4(7(5)11(17,18)21-9)8-6(3)10(15,16)22-12(8,19)20/h1-8H/t3-,4+,5+,6-,7-,8+ |
| InChIKey |
KHOUHCHGBISVRZ-CNVXYERZSA-N |
| Molecular Weight |
336.181 g/mol |
| SMILES |
C1(F)(F)OC(F)(F)[C@]2([C@]3(C=C[C@]([C@]4([C@@]3(C(F)(F)OC4(F)F)[H])[H])([C@@]12[H])[H])[H])[H] |
| Spectrum/Structure Validation Score (Vapor Phase IR) |
0.916039 |
