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2-(2,4-difluorophenyl)-1,1-difluoro-1-mesyl-3-(1,2,4-triazol-1-yl)propan-2-ol
SpectraBase Compound ID 7x8eucXnACS
InChI InChI=1S/C12H11F4N3O3S/c1-23(21,22)12(15,16)11(20,5-19-7-17-6-18-19)9-3-2-8(13)4-10(9)14/h2-4,6-7,20H,5H2,1H3
InChIKey KKHPTFRZYJCFOQ-UHFFFAOYSA-N
Mol Weight 353.29 g/mol
Molecular Formula C12H11F4N3O3S
Exact Mass 353.045725 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 2XzHmsUcwLf
Name 2-(2,4-difluorophenyl)-1,1-difluoro-1-mesyl-3-(1,2,4-triazol-1-yl)propan-2-ol
Comments Less than 3 mono-isotopic peaks
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Formula C12H11F4N3O3S
InChI InChI=1S/C12H11F4N3O3S/c1-23(21,22)12(15,16)11(20,5-19-7-17-6-18-19)9-3-2-8(13)4-10(9)14/h2-4,6-7,20H,5H2,1H3
InChIKey KKHPTFRZYJCFOQ-UHFFFAOYSA-N
Molecular Weight 353.292 g/mol
SMILES OC(C(S(=O)(=O)C)(F)F)(C[n]1ncnc1)c1c(cc(cc1)F)F
SPLASH splash10-0006-0902000000-d179f676535fcc378fae
Source of Spectrum E2-49-180-2
Synonyms 2-(2,4-difluorophenyl)-1,1-difluoro-1-methylsulfonyl-3-(1,2,4-triazol-1-yl)-2-propanol 2-(2,4-difluorophenyl)-1,1-difluoro-1-methylsulfonyl-3-(1,2,4-triazol-1-yl)propan-2-ol 2-[2,4-bis(fluoranyl)phenyl]-1,1-bis(fluoranyl)-1-methylsulfonyl-3-(1,2,4-triazol-1-yl)propan-2-ol
Wiley ID 1555585