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1-[2-(Thiophen-2-yl)ethyl]piperidin-4-yl-pentafluoro propanoate
SpectraBase Compound ID SiNWvpFjlU
InChI InChI=1S/C14H16F5NO2S/c15-13(16,14(17,18)19)12(21)22-10-3-6-20(7-4-10)8-5-11-2-1-9-23-11/h1-2,9-10H,3-8H2
InChIKey IJVFWVUGZFWPSL-UHFFFAOYSA-N
Mol Weight 357.34 g/mol
Molecular Formula C14H16F5NO2S
Exact Mass 357.082191 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID JJ07BqHTRqK
Name 1-[2-(Thiophen-2-yl)ethyl]piperidin-4-yl-pentafluoro propanoate
Classification Chemical
Copyright Copyright © 2024 DigiLab GmbH and Wiley-VCH GmbH. All Rights Reserved.
Exact Mass 357.082190746 u
Formula C14H16F5NO2S
InChI InChI=1S/C14H16F5NO2S/c15-13(16,14(17,18)19)12(21)22-10-3-6-20(7-4-10)8-5-11-2-1-9-23-11/h1-2,9-10H,3-8H2
InChIKey IJVFWVUGZFWPSL-UHFFFAOYSA-N
Ionization Type Electron Ionization (EI)
Molecular Weight 357.339 g/mol
Nominal Mass 357 u
Quality 1000
Retention Index 1693
SMILES C(C(F)(F)F)(C(OC1CCN(CCC=2SC=CC2)CC1)=O)(F)F
SPLASH splash10-03di-2190000000-70bb4fd668818caa959f
Source of Spectrum DigiLab GmbH (C) 2024
Technique GC/MS
Wiley ID DD2024_027136