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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

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID GUvrOErRPxQ
Name tert-Butyl-4-[(4-fluorophenyl)(furan-3-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)23-11-8-18(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
Ionization Type Electron Ionization (EI)
Molecular Weight 388.439 g/mol
Nominal Mass 388 u
Quality 998
Retention Index 2750
SMILES C1(N(C(C=2C=COC2)=O)C2=CC=C(C=C2)F)CCN(C(OC(C)(C)C)=O)CC1
SPLASH splash10-054w-9310000000-ecec27cffcfd76b4ad4c
Sample Comments Structure uncertain
Source of Spectrum DigiLab GmbH (C) 2024
Technique GC/MS
Wiley ID DD2024_028984