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4-(3-HYDROXYPROPYL)-3-UNDECAFLUOROPENTYLPYRAZOLE

View entire compound with spectra: 1 NMR, and 1 MS (GC)

4-(3-HYDROXYPROPYL)-3-UNDECAFLUOROPENTYLPYRAZOLE
SpectraBase Compound ID 69soHq9pjfL
InChI InChI=1S/C11H9F11N2O/c12-7(13,6-5(2-1-3-25)4-23-24-6)8(14,15)9(16,17)10(18,19)11(20,21)22/h4,25H,1-3H2,(H,23,24)
InChIKey RHDXQURBHMLMFY-UHFFFAOYSA-N
Mol Weight 394.19 g/mol
Molecular Formula C11H9F11N2O
Exact Mass 394.053923 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID DsEgeYQOOcy
Name 3-[5-(1,1,2,2,3,3,4,4,5,5,5-undecafluoropentyl)-1H-pyrazol-4-yl]-1-propanol
Alternate Name(s) 3-[5-(1,1,2,2,3,3,4,4,5,5,5-undecafluoropentyl)-1H-pyrazol-4-yl]propan-1-ol 3-[5-[1,1,2,2,3,3,4,4,5,5,5-undecakis(fluoranyl)pentyl]-1H-pyrazol-4-yl]propan-1-ol
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Formula C11H9F11N2O
InChI InChI=1S/C11H9F11N2O/c12-7(13,6-5(2-1-3-25)4-23-24-6)8(14,15)9(16,17)10(18,19)11(20,21)22/h4,25H,1-3H2,(H,23,24)
InChIKey RHDXQURBHMLMFY-UHFFFAOYSA-N
Molecular Weight 394.188 g/mol
SMILES [nH]1cc(CCCO)c(C(C(C(C(C(F)(F)F)(F)F)(F)F)(F)F)(F)F)n1
SPLASH splash10-004i-0609000000-85130310332c342ea6d0
Source of Spectrum KC-0-1042-4
Wiley ID 783611