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tert-butyl 2-(5-(p-tolyl)-4H-1,2,4-triazol-3-yl)piperidine-1-carboxylate
SpectraBase Compound ID CtCwpuAoUdp
InChI InChI=1S/C19H26N4O2/c1-13-8-10-14(11-9-13)16-20-17(22-21-16)15-7-5-6-12-23(15)18(24)25-19(2,3)4/h8-11,15H,5-7,12H2,1-4H3,(H,20,21,22)
InChIKey BHNCMHCEPNVMSD-UHFFFAOYSA-N
Mol Weight 342.44 g/mol
Molecular Formula C19H26N4O2
Exact Mass 342.205576 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID LZaNHRUHK3E
Name tert-butyl 2-(5-(p-tolyl)-4H-1,2,4-triazol-3-yl)piperidine-1-carboxylate
Appearance White solid
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Formula C19H26N4O2
InChI InChI=1S/C19H26N4O2/c1-13-8-10-14(11-9-13)16-20-17(22-21-16)15-7-5-6-12-23(15)18(24)25-19(2,3)4/h8-11,15H,5-7,12H2,1-4H3,(H,20,21,22)
InChIKey BHNCMHCEPNVMSD-UHFFFAOYSA-N
Instrument Name GCMS
Ionization Type EI
Molecular Weight 342.443 g/mol
SMILES [nH]1c(nnc1C1N(CCCC1)C(=O)OC(C)(C)C)-c1ccc(cc1)C
SPLASH splash10-000i-0900000000-c3c16a7ca10cd121c314
Source of Spectrum WO2021074281A1
Wiley ID 1880003