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tert-butyl (S)-2-(5-(p-tolyl)imidazol-2-yl)piperidine-1-carboxylate
SpectraBase Compound ID DRCngD5WiCa
InChI InChI=1S/C20H27N3O2/c1-14-8-10-15(11-9-14)16-13-21-18(22-16)17-7-5-6-12-23(17)19(24)25-20(2,3)4/h8-11,13,17H,5-7,12H2,1-4H3,(H,21,22)/t17-/m0/s1
InChIKey PHIIOBHWAPCHGT-KRWDZBQOSA-N
Mol Weight 341.46 g/mol
Molecular Formula C20H27N3O2
Exact Mass 341.210327 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID GF9nAZO3Ban
Name tert-butyl (S)-2-(5-(p-tolyl)imidazol-2-yl)piperidine-1-carboxylate
Appearance White solid
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Formula C20H27N3O2
InChI InChI=1S/C20H27N3O2/c1-14-8-10-15(11-9-14)16-13-21-18(22-16)17-7-5-6-12-23(17)19(24)25-20(2,3)4/h8-11,13,17H,5-7,12H2,1-4H3,(H,21,22)/t17-/m0/s1
InChIKey PHIIOBHWAPCHGT-KRWDZBQOSA-N
Ionization Type EI
Molecular Weight 341.455 g/mol
SMILES [nH]1c(ncc1-c1ccc(cc1)C)[C@]1(N(CCCC1)C(=O)OC(C)(C)C)[H]
SPLASH splash10-0a4r-9730000000-df59b028df9e2205ed96
Source of Spectrum WO2021074281A1
Wiley ID 1880098