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[1-(3-Methoxybenzyl)-1,2,3-triazol-4-yl]methyl pyrrolidine-1-carboxylate
SpectraBase Compound ID IizD2rrys3h
InChI InChI=1S/C16H20N4O3/c1-22-15-6-4-5-13(9-15)10-20-11-14(17-18-20)12-23-16(21)19-7-2-3-8-19/h4-6,9,11H,2-3,7-8,10,12H2,1H3
InChIKey KNLAMUQHVUFENW-UHFFFAOYSA-N
Mol Weight 316.36 g/mol
Molecular Formula C16H20N4O3
Exact Mass 316.153541 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID EJ7CgzAbpii
Name [1-(3-Methoxybenzyl)-1,2,3-triazol-4-yl]methyl pyrrolidine-1-carboxylate
Comments Computed using HOSE algorithm
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Exact Mass 316.153540517 u
Formula C16H20N4O3
InChI InChI=1S/C16H20N4O3/c1-22-15-6-4-5-13(9-15)10-20-11-14(17-18-20)12-23-16(21)19-7-2-3-8-19/h4-6,9,11H,2-3,7-8,10,12H2,1H3
InChIKey KNLAMUQHVUFENW-UHFFFAOYSA-N
Molecular Weight 316.361 g/mol
SMILES C1N(CCC1)C(=O)OCC=1N=NN(C1)CC1=CC(=CC=C1)OC