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{4-[5-(4-fluorophenyl)-2-methansulfinyl-3-(3-methoxypropyl)-3H-imidazol-4-yl]pyridine-2-yl}isopropylaminee
SpectraBase Compound ID DkpVREaTsC2
InChI InChI=1S/C22H27FN4O2S/c1-15(2)25-19-14-17(10-11-24-19)21-20(16-6-8-18(23)9-7-16)26-22(30(4)28)27(21)12-5-13-29-3/h6-11,14-15H,5,12-13H2,1-4H3,(H,24,25)
InChIKey RGINKPHZFHUGFX-UHFFFAOYSA-N
Mol Weight 430.54 g/mol
Molecular Formula C22H27FN4O2S
Exact Mass 430.183875 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 5fWXnFcUnRT
Name {4-[5-(4-fluorophenyl)-2-methansulfinyl-3-(3-methoxypropyl)-3H-imidazol-4-yl]pyridine-2-yl}isopropylaminee
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Formula C22H27FN4O2S
InChI InChI=1S/C22H27FN4O2S/c1-15(2)25-19-14-17(10-11-24-19)21-20(16-6-8-18(23)9-7-16)26-22(30(4)28)27(21)12-5-13-29-3/h6-11,14-15H,5,12-13H2,1-4H3,(H,24,25)
InChIKey RGINKPHZFHUGFX-UHFFFAOYSA-N
Instrument Name Agilent GC 6890 plus + MSD 5973
Ionization Type EI
Molecular Weight 430.542 g/mol
SMILES N(c1nccc(-c2[n](CCCOC)c(S(=O)C)nc2-c2ccc(F)cc2)c1)C(C)C
SPLASH splash10-03yi-0007900000-ccfc25a537371db3e50c
Source of Spectrum BRPI0608739A2
Wiley ID 1861444