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2-(2,4-Difluorophenyl)-1,1-difluoro-1-(benzylsulfonyl)-3-(1H-1,2,4-triazol-1-yl)-2-propanol
SpectraBase Compound ID FgUz2nKgCJD
InChI InChI=1S/C18H15F4N3O3S/c19-14-6-7-15(16(20)8-14)17(26,10-25-12-23-11-24-25)18(21,22)29(27,28)9-13-4-2-1-3-5-13/h1-8,11-12,26H,9-10H2
InChIKey MGZKJGXEWSCPOR-UHFFFAOYSA-N
Mol Weight 429.39 g/mol
Molecular Formula C18H15F4N3O3S
Exact Mass 429.077025 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 3D1e31ePfC5
Name 2-(2,4-Difluorophenyl)-1,1-difluoro-1-(benzylsulfonyl)-3-(1H-1,2,4-triazol-1-yl)-2-propanol
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Formula C18H15F4N3O3S
InChI InChI=1S/C18H15F4N3O3S/c19-14-6-7-15(16(20)8-14)17(26,10-25-12-23-11-24-25)18(21,22)29(27,28)9-13-4-2-1-3-5-13/h1-8,11-12,26H,9-10H2
InChIKey MGZKJGXEWSCPOR-UHFFFAOYSA-N
Molecular Weight 429.390 g/mol
SMILES OC(C(S(=O)(=O)Cc1ccccc1)(F)F)(C[n]1ncnc1)c1c(cc(cc1)F)F
SPLASH splash10-006x-9040000000-db443e95e580a45cdcab
Source of Spectrum E2-49-182-2
Synonyms 1-(benzylsulfonyl)-2-(2,4-difluorophenyl)-1,1-difluoro-3-(1H-1,2,4-triazol-1-yl)-2-propanol 2-(2,4-difluorophenyl)-1,1-difluoro-1-(phenylmethyl)sulfonyl-3-(1,2,4-triazol-1-yl)-2-propanol 2-[2,4-bis(fluoranyl)phenyl]-1,1-bis(fluoranyl)-1-(phenylmethyl)sulfonyl-3-(1,2,4-triazol-1-yl)propan-2-ol
Wiley ID 1555666