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5-bromo-6-(1,1,2,2,3,3,4,4,4-nonafluorobutoxy)-1,3-benzodioxole
SpectraBase Compound ID 2vnrgrzcIsK
InChI InChI=1S/C11H4BrF9O3/c12-4-1-6-7(23-3-22-6)2-5(4)24-11(20,21)9(15,16)8(13,14)10(17,18)19/h1-2H,3H2
InChIKey GHZMVAFHQFZVRQ-UHFFFAOYSA-N
Mol Weight 435.04 g/mol
Molecular Formula C11H4BrF9O3
Exact Mass 433.92001 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 3gOB9U1dGC
Name 5-bromo-6-(1,1,2,2,3,3,4,4,4-nonafluorobutoxy)-1,3-benzodioxole
Appearance Pale-yellow liquid
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Formula C11H4BrF9O3
InChI InChI=1S/C11H4BrF9O3/c12-4-1-6-7(23-3-22-6)2-5(4)24-11(20,21)9(15,16)8(13,14)10(17,18)19/h1-2H,3H2
InChIKey GHZMVAFHQFZVRQ-UHFFFAOYSA-N
Ionization Type EI
Molecular Weight 435.040 g/mol
Reported Formula C11H4BrF9O3
SMILES c12OCOc2cc(Br)c(OC(F)(F)C(F)(F)C(F)(F)C(F)(F)F)c1
SPLASH splash10-014i-3090600000-e317ad25f2c1d5f7a718
Source of Spectrum CN108516935A
Wiley ID 1870593