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N-(2-(2,4-dichlorophenyl)-2-hydroxyethyl)-N-(4-fluorophenyl)-2-(1H-1,2,4-triazol-1-yl)acetamide
SpectraBase Compound ID Epf3rF5KCt6
InChI InChI=1S/C18H15Cl2FN4O2/c19-12-1-6-15(16(20)7-12)17(26)8-25(14-4-2-13(21)3-5-14)18(27)9-24-11-22-10-23-24/h1-7,10-11,17,26H,8-9H2
InChIKey BWLKGZCPXXLZOE-UHFFFAOYSA-N
Mol Weight 409.25 g/mol
Molecular Formula C18H15Cl2FN4O2
Exact Mass 408.055609 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID DsmOHCDIIqC
Name N-(2-(2,4-dichlorophenyl)-2-hydroxyethyl)-N-(4-fluorophenyl)-2-(1H-1,2,4-triazol-1-yl)acetamide
Appearance White solid
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Formula C18H15Cl2FN4O2
InChI InChI=1S/C18H15Cl2FN4O2/c19-12-1-6-15(16(20)7-12)17(26)8-25(14-4-2-13(21)3-5-14)18(27)9-24-11-22-10-23-24/h1-7,10-11,17,26H,8-9H2
InChIKey BWLKGZCPXXLZOE-UHFFFAOYSA-N
Instrument Name FinniganTrace
Ionization Type EI
Molecular Weight 409.248 g/mol
SMILES OC(CN(C(C[n]1ncnc1)=O)c1ccc(cc1)F)c1c(cc(cc1)Cl)Cl
SPLASH splash10-00e9-0960000000-45421d57e33c5b473176
Source of Spectrum CN106243054A
Wiley ID 1852895