| SpectraBase Spectrum ID |
Bmq3GeX76Ns |
| Name |
1,2-Dibromo-1-(F-hexyl)-2-(F-isopropyl)ethene |
| Comments |
Computed using SmartSpectra Model v1.42 |
| Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass |
669.804739260 u |
| Formula |
C11Br2F20 |
| InChI |
InChI=1S/C11Br2F20/c12-1(3(14,9(25,26)27)10(28,29)30)2(13)4(15,16)5(17,18)6(19,20)7(21,22)8(23,24)11(31,32)33/b2-1+ |
| InChIKey |
CDYLWUYKHGCEIN-OWOJBTEDSA-N |
| Molecular Weight |
671.897 g/mol |
| SMILES |
C(C(C(\C(=C\(C(C(F)(F)F)(C(F)(F)F)F)Br)Br)(F)F)(F)F)(C(C(C(F)(F)F)(F)F)(F)F)(F)F |
| Spectrum/Structure Validation Score (Vapor Phase IR) |
0.872527 |
