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4-(3-HYDROXYPROPYL)-3-PENTADECAFLUOROHEPTYLPYRAZOLE
SpectraBase Compound ID ICK1OMlC9ad
InChI InChI=1S/C13H9F15N2O/c14-7(15,6-5(2-1-3-31)4-29-30-6)8(16,17)9(18,19)10(20,21)11(22,23)12(24,25)13(26,27)28/h4,31H,1-3H2,(H,29,30)
InChIKey BWDVDGYVYDNQEU-UHFFFAOYSA-N
Mol Weight 494.2 g/mol
Molecular Formula C13H9F15N2O
Exact Mass 494.047535 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 8sdf1BxNcl3
Name 3-[5-(1,1,2,2,3,3,4,4,5,5,6,6,7,7,7-pentadecafluoroheptyl)-1H-pyrazol-4-yl]-1-propanol
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Formula C13H9F15N2O
InChI InChI=1S/C13H9F15N2O/c14-7(15,6-5(2-1-3-31)4-29-30-6)8(16,17)9(18,19)10(20,21)11(22,23)12(24,25)13(26,27)28/h4,31H,1-3H2,(H,29,30)
InChIKey BWDVDGYVYDNQEU-UHFFFAOYSA-N
Molecular Weight 494.204 g/mol
SMILES [nH]1cc(CCCO)c(C(C(C(C(C(C(C(F)(F)F)(F)F)(F)F)(F)F)(F)F)(F)F)(F)F)n1
SPLASH splash10-0570-3900800000-6d4b6fd6f3fadbe29d47
Source of Spectrum KC-0-1042-4
Synonyms 3-[5-(1,1,2,2,3,3,4,4,5,5,6,6,7,7,7-pentadecafluoroheptyl)-1H-pyrazol-4-yl]propan-1-ol 3-[5-[1,1,2,2,3,3,4,4,5,5,6,6,7,7,7-pentadecakis(fluoranyl)heptyl]-1H-pyrazol-4-yl]propan-1-ol
Wiley ID 783610