For citations & permissions, please see: Citations & Permissions - Wiley Science Solutions*

*Links on SpectraBase are not permalinks.
Pentedrone TFA (-2H)
SpectraBase Compound ID A4Bo4UxQHnF
InChI InChI=1S/C14H14F3NO2/c1-3-7-11(18(2)13(20)14(15,16)17)12(19)10-8-5-4-6-9-10/h4-9H,3H2,1-2H3/b11-7-
InChIKey JMCVLCATOOMLPA-XFFZJAGNSA-N
Mol Weight 285.27 g/mol
Molecular Formula C14H14F3NO2
Exact Mass 285.097663 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

View the Full Spectrum for FREE!

The full spectrum can only be viewed using a FREE account.

SpectraBase Spectrum ID 2kpW0QyHTAe
Name Pentedrone TFA (-2H)
Classification Cathinone analog designer drug artifact derivative
Copyright Copyright © 2024 DigiLab GmbH and Wiley-VCH GmbH. All Rights Reserved.
Exact Mass 285.097663182 u
Formula C14H14F3NO2
InChI InChI=1S/C14H14F3NO2/c1-3-7-11(18(2)13(20)14(15,16)17)12(19)10-8-5-4-6-9-10/h4-9H,3H2,1-2H3/b11-7-
InChIKey JMCVLCATOOMLPA-XFFZJAGNSA-N
Ionization Type Electron Ionization (EI)
Molecular Weight 285.266 g/mol
Nominal Mass 285 u
Quality 999
Retention Index 1663
SMILES C(\C(N(C(C(F)(F)F)=O)C)=C\CC)(C1=CC=CC=C1)=O
SPLASH splash10-0ar0-8930000000-bde5c98aafc5da7659bd
Sample Comments Double bond position uncertain
Source of Spectrum DigiLab GmbH (C) 2024
Synonyms trifluoro-N-methyl-N-(1-oxo-1-phenylpent-2-en-2-yl)acetamide
Technique GC/MS
Wiley ID DD2024_014338