SpectraBase Compound ID | 2CgK8giHXFG |
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InChI | InChI=1S/C5H2F8/c6-3(7,5(11,12)13)1-2-4(8,9)10/h1-2H/b2-1+ |
InChIKey | CVMVAHSMKGITAV-OWOJBTEDSA-N |
Mol Weight | 214.06 g/mol |
Molecular Formula | C5H2F8 |
Exact Mass | 214.002875 g/mol |
SpectraBase Spectrum ID | 8Rev1cFpXH2 |
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Name | 1,1,1,4,4,5,5,5-Octafluoropent-2-ene |
Comments | Computed using SmartSpectra Model v1.42 |
Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
Exact Mass | 214.002875368 u |
Formula | C5H2F8 |
InChI | InChI=1S/C5H2F8/c6-3(7,5(11,12)13)1-2-4(8,9)10/h1-2H/b2-1+ |
InChIKey | CVMVAHSMKGITAV-OWOJBTEDSA-N |
Molecular Weight | 214.058 g/mol |
SMILES | C(\C=C\C(F)(F)F)(C(F)(F)F)(F)F |
Spectrum/Structure Validation Score (Vapor Phase IR) | 0.964029 |