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Tert-butyl-4-[(4-fluorophenyl)(furan-3-carbonyl)amino]piperidine-1-carboxylate

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Tert-butyl-4-[(4-fluorophenyl)(furan-3-carbonyl)amino]piperidine-1-carboxylate
SpectraBase Compound ID 8dkG1ldgDIA
InChI InChI=1S/C21H25FN2O4/c1-21(2,3)28-20(26)23-11-8-18(9-12-23)24(17-6-4-16(22)5-7-17)19(25)15-10-13-27-14-15/h4-7,10,13-14,18H,8-9,11-12H2,1-3H3
InChIKey FXFJNDXDMZOMGV-UHFFFAOYSA-N
Mol Weight 388.44 g/mol
Molecular Formula C21H25FN2O4
Exact Mass 388.179835 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID IAT53eThV64
Name Tert-butyl-4-[(4-fluorophenyl)(furan-3-carbonyl)amino]piperidine-1-carboxylate
Comments Computed using HOSE algorithm
Copyright Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 388.179835452 u
Formula C21H25FN2O4
InChI InChI=1S/C21H25FN2O4/c1-21(2,3)28-20(26)23-11-8-18(9-12-23)24(17-6-4-16(22)5-7-17)19(25)15-10-13-27-14-15/h4-7,10,13-14,18H,8-9,11-12H2,1-3H3
InChIKey FXFJNDXDMZOMGV-UHFFFAOYSA-N
Molecular Weight 388.439 g/mol
SMILES C1(N(C(C=2C=COC2)=O)C2=CC=C(C=C2)F)CCN(C(OC(C)(C)C)=O)CC1