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Cyclopentyl-{4-[5-(4-fluorophenyl)-2-methanesulfinyl-3-methyl-3H-imidazol-4-yl]pyridin-2-yl}amine
SpectraBase Compound ID 4hno4DUfuLL
InChI InChI=1S/C21H23FN4OS/c1-26-20(15-11-12-23-18(13-15)24-17-5-3-4-6-17)19(25-21(26)28(2)27)14-7-9-16(22)10-8-14/h7-13,17H,3-6H2,1-2H3,(H,23,24)
InChIKey MRAXITSBBSSPJG-UHFFFAOYSA-N
Mol Weight 398.5 g/mol
Molecular Formula C21H23FN4OS
Exact Mass 398.157661 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 6S4xGFPpVqi
Name Cyclopentyl-{4-[5-(4-fluorophenyl)-2-methanesulfinyl-3-methyl-3H-imidazol-4-yl]pyridin-2-yl}amine
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Formula C21H23FN4OS
InChI InChI=1S/C21H23FN4OS/c1-26-20(15-11-12-23-18(13-15)24-17-5-3-4-6-17)19(25-21(26)28(2)27)14-7-9-16(22)10-8-14/h7-13,17H,3-6H2,1-2H3,(H,23,24)
InChIKey MRAXITSBBSSPJG-UHFFFAOYSA-N
Instrument Name Agilent GC 6890 plus + MSD 5973
Ionization Type EI
Molecular Weight 398.500 g/mol
SMILES N(c1nccc(c1)-c1c(nc([n]1C)S(=O)C)-c1ccc(cc1)F)C1CCCC1
SPLASH splash10-03e9-0019000000-1fbafbcce26c26f8f286
Source of Spectrum BRPI0608739A2
Wiley ID 1861448