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2-methyl-1-(2-(5-(p-tolyl)-1H-imidazol-2-yl)piperidin-1-yl)butane-1,3-dione
SpectraBase Compound ID 1n7WibjAHDC
InChI InChI=1S/C20H25N3O2/c1-13-7-9-16(10-8-13)17-12-21-19(22-17)18-6-4-5-11-23(18)20(25)14(2)15(3)24/h7-10,12,14,18H,4-6,11H2,1-3H3,(H,21,22)
InChIKey AOHZXOQJQCYWAN-UHFFFAOYSA-N
Mol Weight 339.44 g/mol
Molecular Formula C20H25N3O2
Exact Mass 339.194677 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID GwYMRSuQ9gu
Name 2-methyl-1-(2-(5-(p-tolyl)-1H-imidazol-2-yl)piperidin-1-yl)butane-1,3-dione
Appearance White solid
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Formula C20H25N3O2
InChI InChI=1S/C20H25N3O2/c1-13-7-9-16(10-8-13)17-12-21-19(22-17)18-6-4-5-11-23(18)20(25)14(2)15(3)24/h7-10,12,14,18H,4-6,11H2,1-3H3,(H,21,22)
InChIKey AOHZXOQJQCYWAN-UHFFFAOYSA-N
Instrument Name GCMS
Ionization Type EI
Molecular Weight 339.439 g/mol
SMILES [nH]1c(cnc1C1N(C(C(C)C(C)=O)=O)CCCC1)-c1ccc(cc1)C
SPLASH splash10-0006-0190000000-8cb8862313e1190cbf3c
Source of Spectrum WO2021074281A1
Wiley ID 1880078