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3-(5-CHLORODECAFLUOROPENTYL)-4,5,6,7-TETRAHYDROINDAZOLE
SpectraBase Compound ID 2bUeq71sOV4
InChI InChI=1S/C12H9ClF10N2/c13-12(22,23)11(20,21)10(18,19)9(16,17)8(14,15)7-5-3-1-2-4-6(5)24-25-7/h1-4H2,(H,24,25)
InChIKey MRXSJLHUKDCBSD-UHFFFAOYSA-N
Mol Weight 406.66 g/mol
Molecular Formula C12H9ClF10N2
Exact Mass 406.029458 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 573XanyZcCt
Name 3-(5-Chloro-1,1,2,2,3,3,4,4,5,5-decafluoro-pentyl)-4,5,6,7-tetrahydro-1H-indazole
Alternate Name(s) 3-[5-chloranyl-1,1,2,2,3,3,4,4,5,5-decakis(fluoranyl)pentyl]-4,5,6,7-tetrahydro-1H-indazole
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Formula C12H9ClF10N2
InChI InChI=1S/C12H9ClF10N2/c13-12(22,23)11(20,21)10(18,19)9(16,17)8(14,15)7-5-3-1-2-4-6(5)24-25-7/h1-4H2,(H,24,25)
InChIKey MRXSJLHUKDCBSD-UHFFFAOYSA-N
Molecular Weight 406.655 g/mol
SMILES [nH]1c2c(c(n1)C(C(C(C(C(Cl)(F)F)(F)F)(F)F)(F)F)(F)F)CCCC2
SPLASH splash10-05i3-0906300000-17a1a298224ee41071d7
Source of Spectrum KC-0-1042-4
Wiley ID 783620