SpectraBase Spectrum ID |
GopZ3lkVIFO |
Name |
5-(Chloromethyl)-1,1,2,2,3,3,4,4-octafluorocyclopentane |
Comments |
Computed using SmartSpectra Model v1.42 |
Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
Exact Mass |
261.979553101 u |
Formula |
C6H3ClF8 |
InChI |
InChI=1S/C6H3ClF8/c7-1-2-3(8,9)5(12,13)6(14,15)4(2,10)11/h2H,1H2 |
InChIKey |
YVLDFKOPTVXHEU-UHFFFAOYSA-N |
Molecular Weight |
262.530 g/mol |
SMILES |
C1(C(C(CCl)C(C1(F)F)(F)F)(F)F)(F)F |
Spectrum/Structure Validation Score (Vapor Phase IR) |
0.90603 |