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{4-[5-(4-fluorophenyl)-2-methansulfinyl-3-(2-methoxyethyl)-3H-imidazoI-4-yl]pyridine-2-yl}(l-phenylethyl)amine
SpectraBase Compound ID 2DYNaq0MulZ
InChI InChI=1S/C21H25FN4O2S/c1-14(2)24-18-13-16(9-10-23-18)20-19(15-5-7-17(22)8-6-15)25-21(29(4)27)26(20)11-12-28-3/h5-10,13-14H,11-12H2,1-4H3,(H,23,24)
InChIKey ADRUMUUMWYZKAN-UHFFFAOYSA-N
Mol Weight 416.52 g/mol
Molecular Formula C21H25FN4O2S
Exact Mass 416.168225 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID BBk5kPZErs0
Name {4-[5-(4-fluorophenyl)-2-methansulfinyl-3-(2-methoxyethyl)-3H-imidazoI-4-yl]pyridine-2-yl}(l-phenylethyl)amine
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C21H25FN4O2S
InChI InChI=1S/C21H25FN4O2S/c1-14(2)24-18-13-16(9-10-23-18)20-19(15-5-7-17(22)8-6-15)25-21(29(4)27)26(20)11-12-28-3/h5-10,13-14H,11-12H2,1-4H3,(H,23,24)
InChIKey ADRUMUUMWYZKAN-UHFFFAOYSA-N
Instrument Name Agilent GC 6890 plus + MSD 5973
Ionization Type EI
Molecular Weight 416.515 g/mol
SMILES N(c1cc(-c2c(-c3ccc(cc3)F)nc([n]2CCOC)S(C)=O)ccn1)C(C)C
SPLASH splash10-0udi-0007900000-2ca143cf71fb3067148e
Source of Spectrum BRPI0608739A2
Wiley ID 1861445