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2-(methylthio)-1-(2-(5-(p-tolyl)imidazol-2-yl)piperidin-1-yl)propan-1-one
SpectraBase Compound ID BPzx0heqKth
InChI InChI=1S/C19H25N3OS/c1-13-7-9-15(10-8-13)16-12-20-18(21-16)17-6-4-5-11-22(17)19(23)14(2)24-3/h7-10,12,14,17H,4-6,11H2,1-3H3,(H,20,21)
InChIKey ZIQSNLRVUZTLJR-UHFFFAOYSA-N
Mol Weight 343.49 g/mol
Molecular Formula C19H25N3OS
Exact Mass 343.171834 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 4tXOohWqTUx
Name 2-(methylthio)-1-(2-(5-(p-tolyl)imidazol-2-yl)piperidin-1-yl)propan-1-one
Appearance White solid
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Formula C19H25N3OS
InChI InChI=1S/C19H25N3OS/c1-13-7-9-15(10-8-13)16-12-20-18(21-16)17-6-4-5-11-22(17)19(23)14(2)24-3/h7-10,12,14,17H,4-6,11H2,1-3H3,(H,20,21)
InChIKey ZIQSNLRVUZTLJR-UHFFFAOYSA-N
Ionization Type EI
Molecular Weight 343.489 g/mol
SMILES [nH]1c(ncc1-c1ccc(cc1)C)C1N(C(C(C)SC)=O)CCCC1
SPLASH splash10-0006-6190000000-e66eb20d41c0209a6864
Source of Spectrum WO2021074281A1
Wiley ID 1880061