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4-piperidinecarboxamide, N-(3-fluorophenyl)-1-(7H-purin-6-yl)-

View entire compound with spectra: 2 NMR

4-piperidinecarboxamide, N-(3-fluorophenyl)-1-(7H-purin-6-yl)-
SpectraBase Compound ID 7CM0dtlxn8R
InChI InChI=1S/C17H17FN6O/c18-12-2-1-3-13(8-12)23-17(25)11-4-6-24(7-5-11)16-14-15(20-9-19-14)21-10-22-16/h1-3,8-11H,4-7H2,(H,23,25)(H,19,20,21,22)
InChIKey LYLKWVQKOLASRD-UHFFFAOYSA-N
Mol Weight 340.36 g/mol
Molecular Formula C17H17FN6O
Exact Mass 340.144787 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 2fHVHruPKYN
Name 4-Piperidinecarboxamide, N-(3-fluorophenyl)-1-(7H-purin-6-yl)-
Comments Computed using HOSE algorithm
Copyright Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 340.144787353 u
Formula C17H17FN6O
InChI InChI=1S/C17H17FN6O/c18-12-2-1-3-13(8-12)23-17(25)11-4-6-24(7-5-11)16-14-15(20-9-19-14)21-10-22-16/h1-3,8-11H,4-7H2,(H,23,25)(H,19,20,21,22)
InChIKey LYLKWVQKOLASRD-UHFFFAOYSA-N
Molecular Weight 340.362 g/mol
SMILES N(C(C1CCN(C2=C3C(=NC=N2)N=CN3)CC1)=O)C=1C=C(F)C=CC1