SpectraBase Compound ID | EqU8zIi7YcQ |
---|---|
InChI | InChI=1S/C4F6/c5-1(3(7)8)2(6)4(9)10 |
InChIKey | LGPPATCNSOSOQH-UHFFFAOYSA-N |
Mol Weight | 162.03 g/mol |
Molecular Formula | C4F6 |
Exact Mass | 161.990419 g/mol |
SpectraBase Spectrum ID | Hk0xuUMGc6B |
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Name | 1,3-Butadiene, 1,1,2,3,4,4-hexafluoro- |
Comments | Computed using SmartSpectra Model v1.42 |
Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
Exact Mass | 161.990418978 u |
Formula | C4F6 |
InChI | InChI=1S/C4F6/c5-1(3(7)8)2(6)4(9)10 |
InChIKey | LGPPATCNSOSOQH-UHFFFAOYSA-N |
Molecular Weight | 162.034 g/mol |
SMILES | C(F)(F)=C(F)C(F)=C(F)F |
Spectrum/Structure Validation Score (Vapor Phase IR) | 0.844602 |