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[1-(4-Fluorobenzyl)-1,2,3-triazol-4-yl]methyl pyrrolidine-1-carboxylate
SpectraBase Compound ID BC6a6s20as4
InChI InChI=1S/C15H17FN4O2/c16-13-5-3-12(4-6-13)9-20-10-14(17-18-20)11-22-15(21)19-7-1-2-8-19/h3-6,10H,1-2,7-9,11H2
InChIKey JTNULVHXNMTUJC-UHFFFAOYSA-N
Mol Weight 304.33 g/mol
Molecular Formula C15H17FN4O2
Exact Mass 304.133554 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID BsydpFY5r5h
Name [1-(4-Fluorobenzyl)-1,2,3-triazol-4-yl]methyl pyrrolidine-1-carboxylate
Comments Computed using HOSE algorithm
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Exact Mass 304.133553964 u
Formula C15H17FN4O2
InChI InChI=1S/C15H17FN4O2/c16-13-5-3-12(4-6-13)9-20-10-14(17-18-20)11-22-15(21)19-7-1-2-8-19/h3-6,10H,1-2,7-9,11H2
InChIKey JTNULVHXNMTUJC-UHFFFAOYSA-N
Molecular Weight 304.325 g/mol
SMILES C1N(CCC1)C(=O)OCC=1N=NN(C1)CC1=CC=C(C=C1)F