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3,3,4,4,5,5,5-heptafluoro-2-methylpentanal
SpectraBase Compound ID E7ZTadocAx5
InChI InChI=1S/C6H5F7O/c1-3(2-14)4(7,8)5(9,10)6(11,12)13/h2-3H,1H3
InChIKey LIVMJRVNDYMEMQ-UHFFFAOYSA-N
Mol Weight 226.09 g/mol
Molecular Formula C6H5F7O
Exact Mass 226.022862 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 9XUnjSGuEmm
Name 3,3,4,4,5,5,5-heptafluoro-2-methylpentanal
CAS Registry Number 111160-51-1
Comments Less than 3 mono-isotopic peaks
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Formula C6H5F7O
InChI InChI=1S/C6H5F7O/c1-3(2-14)4(7,8)5(9,10)6(11,12)13/h2-3H,1H3
InChIKey LIVMJRVNDYMEMQ-UHFFFAOYSA-N
Molecular Weight 226.094 g/mol
SMILES C(C(C(C=O)C)(F)F)(C(F)(F)F)(F)F
SPLASH splash10-0a4i-0900000000-be5a19edb79195fee833
Source of Spectrum C-109-7719-0
Synonyms 3,3,4,4,5,5,5-heptafluoro-2-methyl-pentanal 3,3,4,4,5,5,5-heptakis(fluoranyl)-2-methyl-pentanal
Wiley ID 1226701