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2-Pyrazolin-5-ol, 1-(4-chlorobenzoyl)-5-perfluoroctyl-3-methyl-
SpectraBase Compound ID 7RF2pHjrKFX
InChI InChI=1S/C19H10ClF17N2O2/c1-7-6-11(41,39(38-7)10(40)8-2-4-9(20)5-3-8)12(21,22)13(23,24)14(25,26)15(27,28)16(29,30)17(31,32)18(33,34)19(35,36)37/h2-5,41H,6H2,1H3
InChIKey USSRMJUNUNRRRW-UHFFFAOYSA-N
Mol Weight 656.73 g/mol
Molecular Formula C19H10ClF17N2O2
Exact Mass 656.015934 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 1adYik6HjVe
Name 2-Pyrazolin-5-ol, 1-(4-chlorobenzoyl)-5-perfluoroctyl-3-methyl-
Alternate Name(s) (4-chlorophenyl)-[5-(1,1,2,2,3,3,4,4,5,5,6,6,7,7,8,8,8-heptadecafluorooctyl)-5-hydroxy-3-methyl-2-pyrazolin-1-yl]methanone (4-chlorophenyl)-[5-(1,1,2,2,3,3,4,4,5,5,6,6,7,7,8,8,8-heptadecafluorooctyl)-5-hydroxy-3-methyl-4H-pyrazol-1-yl]methanone (4-chlorophenyl)-[5-[1,1,2,2,3,3,4,4,5,5,6,6,7,7,8,8,8-heptadecakis(fluoranyl)octyl]-3-methyl-5-oxidanyl-4H-pyrazol-1-yl]methanone 1-(4-Chlorobenzoyl)-5-(1,1,2,2,3,3,4,4,5,5,6,6,7,7,8,8,8-heptadecafluorooctyl)-3-methyl-4,5-dihydro-1H-pyrazol-5-ol
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Formula C19H10ClF17N2O2
InChI InChI=1S/C19H10ClF17N2O2/c1-7-6-11(41,39(38-7)10(40)8-2-4-9(20)5-3-8)12(21,22)13(23,24)14(25,26)15(27,28)16(29,30)17(31,32)18(33,34)19(35,36)37/h2-5,41H,6H2,1H3
InChIKey USSRMJUNUNRRRW-UHFFFAOYSA-N
Molecular Weight 656.727 g/mol
SMILES OC1(N(N=C(C1)C)C(c1ccc(cc1)Cl)=O)C(C(C(C(C(C(C(C(F)(F)F)(F)F)(F)F)(F)F)(F)F)(F)F)(F)F)(F)F
SPLASH splash10-000i-2900000000-23ec1c9cec5d53a64822
Source of Spectrum AD-0-2532-0
Wiley ID 1419963