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tert-Butyl-4-[(3-fluorophenyl)(5-methylfuran-2-carbonyl)amino]piperidine-1-carboxylate
SpectraBase Compound ID 1jjdNGPXQeH
InChI InChI=1S/C22H27FN2O4/c1-15-8-9-19(28-15)20(26)25(18-7-5-6-16(23)14-18)17-10-12-24(13-11-17)21(27)29-22(2,3)4/h5-9,14,17H,10-13H2,1-4H3
InChIKey QGOOJZRYHWIAIF-UHFFFAOYSA-N
Mol Weight 402.47 g/mol
Molecular Formula C22H27FN2O4
Exact Mass 402.195486 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 5XsDc9O1ya0
Name tert-Butyl-4-[(3-fluorophenyl)(5-methylfuran-2-carbonyl)amino]piperidine-1-carboxylate
Classification Chemical
Copyright Copyright © 2024 DigiLab GmbH and Wiley-VCH GmbH. All Rights Reserved.
Exact Mass 402.195485516 u
Formula C22H27FN2O4
InChI InChI=1S/C22H27FN2O4/c1-15-8-9-19(28-15)20(26)25(18-7-5-6-16(23)14-18)17-10-12-24(13-11-17)21(27)29-22(2,3)4/h5-9,14,17H,10-13H2,1-4H3
InChIKey QGOOJZRYHWIAIF-UHFFFAOYSA-N
Ionization Type Electron Ionization (EI)
Molecular Weight 402.466 g/mol
Nominal Mass 402 u
Quality 995
Retention Index 2810
SMILES C(N(C1CCN(C(OC(C)(C)C)=O)CC1)C1=CC(=CC=C1)F)(C=1OC(=CC1)C)=O
SPLASH splash10-0pbc-9820000000-72c4cacb9e0f59d23c4a
Sample Comments Structure uncertain
Source of Spectrum DigiLab GmbH (C) 2024
Technique GC/MS
Wiley ID DD2024_028991