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N-1-[2-(2,3-Dihydrothiophen-2-yl)ethyl]-N-(3-fluorophenyl)-N-(2,2,3,3,4,4,4-heptafluorobutyl)piperidin-4-amine
SpectraBase Compound ID 6X5Bawkb96J
InChI InChI=1S/C21H24F8N2S/c22-15-3-1-4-17(13-15)31(14-19(23,24)20(25,26)21(27,28)29)16-6-9-30(10-7-16)11-8-18-5-2-12-32-18/h1-4,12-13,16,18H,5-11,14H2
InChIKey UKLBMOUXMVXAMB-UHFFFAOYSA-N
Mol Weight 488.48 g/mol
Molecular Formula C21H24F8N2S
Exact Mass 488.153245 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 2m6UkzkigrY
Name N-1-[2-(2,3-Dihydrothiophen-2-yl)ethyl]-N-(3-fluorophenyl)-N-(2,2,3,3,4,4,4-heptafluorobutyl)piperidin-4-amine
Classification Chemical
Copyright Copyright © 2024 DigiLab GmbH and Wiley-VCH GmbH. All Rights Reserved.
Exact Mass 488.153245259 u
Formula C21H24F8N2S
InChI InChI=1S/C21H24F8N2S/c22-15-3-1-4-17(13-15)31(14-19(23,24)20(25,26)21(27,28)29)16-6-9-30(10-7-16)11-8-18-5-2-12-32-18/h1-4,12-13,16,18H,5-11,14H2
InChIKey UKLBMOUXMVXAMB-UHFFFAOYSA-N
Ionization Type Electron Ionization (EI)
Molecular Weight 488.484 g/mol
Nominal Mass 488 u
Quality 985
Retention Index 3596
SMILES C(C(C(F)(F)F)(F)F)(CN(C1=CC(=CC=C1)F)C1CCN(CC1)CCC1SC=CC1)(F)F
SPLASH splash10-000g-7109000000-eee7842ae6e659034521
Source of Spectrum DigiLab GmbH (C) 2024
Technique GC/MS
Wiley ID DD2024_026730