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2-(1,3-benzodioxol-5-yl)-1,1,1,4,4,4-hexafluoro-butane-2,3-diol
SpectraBase Compound ID 2N2ZRhe1rWN
InChI InChI=1S/C11H8F6O4/c12-10(13,14)8(18)9(19,11(15,16)17)5-1-2-6-7(3-5)21-4-20-6/h1-3,8,18-19H,4H2
InChIKey YRJQWDCVLPNAGM-UHFFFAOYSA-N
Mol Weight 318.17 g/mol
Molecular Formula C11H8F6O4
Exact Mass 318.032678 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 9If3rZSnIMb
Name 2-(1,3-benzodioxol-5-yl)-1,1,1,4,4,4-hexafluoro-butane-2,3-diol
Alternate Name(s) 2-(1,3-benzodioxol-5-yl)-1,1,1,4,4,4-hexakis(fluoranyl)butane-2,3-diol
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Formula C11H8F6O4
InChI InChI=1S/C11H8F6O4/c12-10(13,14)8(18)9(19,11(15,16)17)5-1-2-6-7(3-5)21-4-20-6/h1-3,8,18-19H,4H2
InChIKey YRJQWDCVLPNAGM-UHFFFAOYSA-N
Molecular Weight 318.171 g/mol
SMILES OC(C(C(F)(F)F)(c1cc2OCOc2cc1)O)C(F)(F)F
SPLASH splash10-00kb-9872000000-6e516783fc59efcd23fa
Source of Spectrum J-66-1440-16
Wiley ID 1534548