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5-Amino-3-(perfluoroheptyl)-1,2,4-oxadiazole
SpectraBase Compound ID EujzSkyGrI4
InChI InChI=1S/C9H2F15N3O/c10-3(11,1-26-2(25)28-27-1)4(12,13)5(14,15)6(16,17)7(18,19)8(20,21)9(22,23)24/h(H2,25,26,27)
InChIKey ACYUPEVDCANOTO-UHFFFAOYSA-N
Mol Weight 453.11 g/mol
Molecular Formula C9H2F15N3O
Exact Mass 452.995834 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID FoZ9hsW5EmK
Name 5-Amino-3-(perfluoroheptyl)-1,2,4-oxadiazole
Alternate Name(s) 3-(1,1,2,2,3,3,4,4,5,5,6,6,7,7,7-pentadecafluoroheptyl)-1,2,4-oxadiazol-5-amine 3-(1,1,2,2,3,3,4,4,5,5,6,6,7,7,7-pentadecafluoroheptyl)-1,2,4-oxadiazol-5-ylamine
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Formula C9H2F15N3O
InChI InChI=1S/C9H2F15N3O/c10-3(11,1-26-2(25)28-27-1)4(12,13)5(14,15)6(16,17)7(18,19)8(20,21)9(22,23)24/h(H2,25,26,27)
InChIKey ACYUPEVDCANOTO-UHFFFAOYSA-N
Molecular Weight 453.111 g/mol
SMILES Nc1nc(C(C(C(C(C(C(C(F)(F)F)(F)F)(F)F)(F)F)(F)F)(F)F)(F)F)no1
SPLASH splash10-001i-3900400000-b867cb4438dba0c46747
Source of Spectrum O1-57-1893-3
Wiley ID 1591758