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1-[2-(Thiophen-2-yl)ethyl]piperidin-4-yl-trifluoroacetate
SpectraBase Compound ID DWFgN8jnuxQ
InChI InChI=1S/C13H16F3NO2S/c14-13(15,16)12(18)19-10-3-6-17(7-4-10)8-5-11-2-1-9-20-11/h1-2,9-10H,3-8H2
InChIKey KTGMWFSMHJCNLX-UHFFFAOYSA-N
Mol Weight 307.33 g/mol
Molecular Formula C13H16F3NO2S
Exact Mass 307.085384 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 8HfFfhzRhvk
Name 1-[2-(Thiophen-2-yl)ethyl]piperidin-4-yl-trifluoroacetate
Classification Chemical
Copyright Copyright © 2024 DigiLab GmbH and Wiley-VCH GmbH. All Rights Reserved.
Exact Mass 307.085384420 u
Formula C13H16F3NO2S
InChI InChI=1S/C13H16F3NO2S/c14-13(15,16)12(18)19-10-3-6-17(7-4-10)8-5-11-2-1-9-20-11/h1-2,9-10H,3-8H2
InChIKey KTGMWFSMHJCNLX-UHFFFAOYSA-N
Ionization Type Electron Ionization (EI)
Molecular Weight 307.331 g/mol
Nominal Mass 307 u
Quality 999
Retention Index 1690
SMILES C(C(OC1CCN(CCC=2SC=CC2)CC1)=O)(F)(F)F
SPLASH splash10-03di-6190000000-050b8daa3ea61fa534a6
Source of Spectrum DigiLab GmbH (C) 2024
Technique GC/MS
Wiley ID DD2024_027135