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Tert.-butyl-N-[3-[[(4-fluorophenyl)-methyl]-amino]-propyl]-N-[4-[[(tert.-butyloxy)-carbonyl]-amino]-butyl]-carbamate

View entire compound with spectra: 2 NMR

Tert.-butyl-N-[3-[[(4-fluorophenyl)-methyl]-amino]-propyl]-N-[4-[[(tert.-butyloxy)-carbonyl]-amino]-butyl]-carbamate
SpectraBase Compound ID 2KSRsdgLXbt
InChI InChI=1S/C24H40FN3O4/c1-23(2,3)31-21(29)27-15-7-8-16-28(22(30)32-24(4,5)6)17-9-14-26-18-19-10-12-20(25)13-11-19/h10-13,26H,7-9,14-18H2,1-6H3,(H,27,29)
InChIKey QGXGYNYWKXOZMT-UHFFFAOYSA-N
Mol Weight 453.6 g/mol
Molecular Formula C24H40FN3O4
Exact Mass 453.300285 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 8Az6DpBn0dc
Name Tert.-butyl-N-[3-[[(4-fluorophenyl)-methyl]-amino]-propyl]-N-[4-[[(tert.-butyloxy)-carbonyl]-amino]-butyl]-carbamate
Comments Computed using HOSE algorithm
Copyright Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 453.300284939 u
Formula C24H40FN3O4
InChI InChI=1S/C24H40FN3O4/c1-23(2,3)31-21(29)27-15-7-8-16-28(22(30)32-24(4,5)6)17-9-14-26-18-19-10-12-20(25)13-11-19/h10-13,26H,7-9,14-18H2,1-6H3,(H,27,29)
InChIKey QGXGYNYWKXOZMT-UHFFFAOYSA-N
Molecular Weight 453.599 g/mol
SMILES C(NCCCN(CCCCNC(=O)OC(C)(C)C)C(=O)OC(C)(C)C)C1=CC=C(C=C1)F