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4,5-(Tetramethylene)-2,3-dihydro-3-(perfluorohexyl)-3-hydroxyisoxazol
SpectraBase Compound ID 5p3n0iLZnAV
InChI InChI=1S/C13H10F13NO2/c14-8(15,7(28)5-3-1-2-4-6(5)29-27-7)9(16,17)10(18,19)11(20,21)12(22,23)13(24,25)26/h27-28H,1-4H2
InChIKey FJCWARQMYINWCT-UHFFFAOYSA-N
Mol Weight 459.21 g/mol
Molecular Formula C13H10F13NO2
Exact Mass 459.050395 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 1LYUzVEkQ6c
Name 4,5-(Tetramethylene)-2,3-dihydro-3-(perfluorohexyl)-3-hydroxyisoxazol
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Formula C13H10F13NO2
InChI InChI=1S/C13H10F13NO2/c14-8(15,7(28)5-3-1-2-4-6(5)29-27-7)9(16,17)10(18,19)11(20,21)12(22,23)13(24,25)26/h27-28H,1-4H2
InChIKey FJCWARQMYINWCT-UHFFFAOYSA-N
Molecular Weight 459.207 g/mol
SMILES N1OC2=C(C1(C(C(C(C(C(C(F)(F)F)(F)F)(F)F)(F)F)(F)F)(F)F)O)CCCC2
SPLASH splash10-00dl-0900000000-e5918f90e3285a5e50e1
Source of Spectrum H-85-1966-2
Synonyms 3-(1,1,2,2,3,3,4,4,5,5,6,6,6-tridecafluorohexyl)-2,3,4,5,6,7-hexahydro-1,2-benzisoxazol-3-ol
Wiley ID 1524579