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2-methyl-1-(2-(5-(o-tolyl)-1H-imidazol-2-yl)piperidin-1-yl)butan-1-one
SpectraBase Compound ID IxtV3qxOV26
InChI InChI=1S/C20H27N3O/c1-4-14(2)20(24)23-12-8-7-11-18(23)19-21-13-17(22-19)16-10-6-5-9-15(16)3/h5-6,9-10,13-14,18H,4,7-8,11-12H2,1-3H3,(H,21,22)
InChIKey WETPZJKYPUSECE-UHFFFAOYSA-N
Mol Weight 325.46 g/mol
Molecular Formula C20H27N3O
Exact Mass 325.215413 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID HE7FpbCORUL
Name 2-methyl-1-(2-(5-(o-tolyl)-1H-imidazol-2-yl)piperidin-1-yl)butan-1-one
Appearance White solid
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Formula C20H27N3O
InChI InChI=1S/C20H27N3O/c1-4-14(2)20(24)23-12-8-7-11-18(23)19-21-13-17(22-19)16-10-6-5-9-15(16)3/h5-6,9-10,13-14,18H,4,7-8,11-12H2,1-3H3,(H,21,22)
InChIKey WETPZJKYPUSECE-UHFFFAOYSA-N
Instrument Name GCMS
Ionization Type EI
Molecular Weight 325.456 g/mol
SMILES [nH]1c(cnc1C1N(C(C(C)CC)=O)CCCC1)-c1c(cccc1)C
SPLASH splash10-0006-0190000000-04be63342368fc1e7c36
Source of Spectrum WO2021074281A1
Wiley ID 1880024