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[1-(3,4-Difluorobenzyl)-1,2,3-triazol-4-yl]methyl pyrrolidine-1-carboxylate
SpectraBase Compound ID HqRpXUQjZOl
InChI InChI=1S/C15H16F2N4O2/c16-13-4-3-11(7-14(13)17)8-21-9-12(18-19-21)10-23-15(22)20-5-1-2-6-20/h3-4,7,9H,1-2,5-6,8,10H2
InChIKey RTVMIOZDEKRJKG-UHFFFAOYSA-N
Mol Weight 322.32 g/mol
Molecular Formula C15H16F2N4O2
Exact Mass 322.124132 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID Lf8A3i0vJEh
Name [1-(3,4-Difluorobenzyl)-1,2,3-triazol-4-yl]methyl pyrrolidine-1-carboxylate
Comments Computed using HOSE algorithm
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Exact Mass 322.124132095 u
Formula C15H16F2N4O2
InChI InChI=1S/C15H16F2N4O2/c16-13-4-3-11(7-14(13)17)8-21-9-12(18-19-21)10-23-15(22)20-5-1-2-6-20/h3-4,7,9H,1-2,5-6,8,10H2
InChIKey RTVMIOZDEKRJKG-UHFFFAOYSA-N
Molecular Weight 322.316 g/mol
SMILES C1N(CCC1)C(=O)OCC=1N=NN(C1)CC1=CC(=C(C=C1)F)F