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tert-Butyl-4-[(2-fluorophenyl)(furan-2-carbonyl)amino]piperidine-1-carboxylate
SpectraBase Compound ID 85BdaY3Wusr
InChI InChI=1S/C21H25FN2O4/c1-21(2,3)28-20(26)23-12-10-15(11-13-23)24(17-8-5-4-7-16(17)22)19(25)18-9-6-14-27-18/h4-9,14-15H,10-13H2,1-3H3
InChIKey NDFWVIUTLAOUGH-UHFFFAOYSA-N
Mol Weight 388.44 g/mol
Molecular Formula C21H25FN2O4
Exact Mass 388.179835 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID K5lOpuSQNpe
Name tert-Butyl-4-[(2-fluorophenyl)(furan-2-carbonyl)amino]piperidine-1-carboxylate
Classification Chemical
Copyright Copyright © 2024 DigiLab GmbH and Wiley-VCH GmbH. All Rights Reserved.
Exact Mass 388.179835452 u
Formula C21H25FN2O4
InChI InChI=1S/C21H25FN2O4/c1-21(2,3)28-20(26)23-12-10-15(11-13-23)24(17-8-5-4-7-16(17)22)19(25)18-9-6-14-27-18/h4-9,14-15H,10-13H2,1-3H3
InChIKey NDFWVIUTLAOUGH-UHFFFAOYSA-N
Ionization Type Electron Ionization (EI)
Molecular Weight 388.439 g/mol
Nominal Mass 388 u
Quality 994
Retention Index 2760
SMILES C=1(N(C2CCN(C(OC(C)(C)C)=O)CC2)C(C=2OC=CC2)=O)C(=CC=CC1)F
SPLASH splash10-0a6u-9420000000-ff1cb66a855f5bdbc0dd
Sample Comments Structure uncertain
Source of Spectrum DigiLab GmbH (C) 2024
Technique GC/MS
Wiley ID DD2024_028995