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Cycloheptyl-{4-[5-(4-fluorophenyl)-2-methanesulfinyl-3-methyl-3H-imidazol-4-yl]pyridin-2-yl}amine
SpectraBase Compound ID GOtYM6F6kZM
InChI InChI=1S/C23H27FN4OS/c1-28-22(21(27-23(28)30(2)29)16-9-11-18(24)12-10-16)17-13-14-25-20(15-17)26-19-7-5-3-4-6-8-19/h9-15,19H,3-8H2,1-2H3,(H,25,26)
InChIKey DNLVDOVCRBSTGN-UHFFFAOYSA-N
Mol Weight 426.55 g/mol
Molecular Formula C23H27FN4OS
Exact Mass 426.188961 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 26Wl64XfduA
Name Cycloheptyl-{4-[5-(4-fluorophenyl)-2-methanesulfinyl-3-methyl-3H-imidazol-4-yl]pyridin-2-yl}amine
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Formula C23H27FN4OS
InChI InChI=1S/C23H27FN4OS/c1-28-22(21(27-23(28)30(2)29)16-9-11-18(24)12-10-16)17-13-14-25-20(15-17)26-19-7-5-3-4-6-8-19/h9-15,19H,3-8H2,1-2H3,(H,25,26)
InChIKey DNLVDOVCRBSTGN-UHFFFAOYSA-N
Instrument Name Agilent GC 6890 plus + MSD 5973
Ionization Type EI
Molecular Weight 426.554 g/mol
SMILES N(c1nccc(c1)-c1[n](C)c(S(=O)C)nc1-c1ccc(F)cc1)C1CCCCCC1
SPLASH splash10-03fr-0129200000-73003eb9b19ee6151632
Source of Spectrum BRPI0608739A2
Wiley ID 1861449