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1,1-DIFLUORO-2-(4-FLUOROPHENYL)-1-(METHYLSULFONYL)-3-(1H-1,2,4-TRIAZOL-1-YL)-2-PROPANOL
SpectraBase Compound ID 5WVvXqPTg96
InChI InChI=1S/C12H12F3N3O3S/c1-22(20,21)12(14,15)11(19,6-18-8-16-7-17-18)9-2-4-10(13)5-3-9/h2-5,7-8,19H,6H2,1H3
InChIKey BHVWEWHXFLUUKT-UHFFFAOYSA-N
Mol Weight 335.3 g/mol
Molecular Formula C12H12F3N3O3S
Exact Mass 335.055147 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID EOjDGArueSk
Name 1,1-bis(fluoranyl)-2-(4-fluorophenyl)-1-methylsulfonyl-3-(1,2,4-triazol-1-yl)propan-2-ol
Alternate Name(s) 1,1-Difluoro-2-(4-fluorophenyl)-1-mesyl-3-(1,2,4-triazol-1-yl)propan-2-ol 1,1-Difluoro-2-(4-fluorophenyl)-1-methylsulfonyl-3-(1,2,4-triazol-1-yl)-2-propanol 1,1-Difluoro-2-(4-fluorophenyl)-1-methylsulfonyl-3-(1,2,4-triazol-1-yl)propan-2-ol
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Formula C12H12F3N3O3S
InChI InChI=1S/C12H12F3N3O3S/c1-22(20,21)12(14,15)11(19,6-18-8-16-7-17-18)9-2-4-10(13)5-3-9/h2-5,7-8,19H,6H2,1H3
InChIKey BHVWEWHXFLUUKT-UHFFFAOYSA-N
Molecular Weight 335.301 g/mol
SMILES OC(C(S(=O)(=O)C)(F)F)(C[n]1ncnc1)c1ccc(cc1)F
SPLASH splash10-05fr-0980000000-4673ee5aa6f738d4bfba
Source of Spectrum E2-49-181-2
Wiley ID 1555577