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Pentedrone TFA
SpectraBase Compound ID 8135kqDbao1
InChI InChI=1S/C14H16F3NO2/c1-3-7-11(18(2)13(20)14(15,16)17)12(19)10-8-5-4-6-9-10/h4-6,8-9,11H,3,7H2,1-2H3
InChIKey ACGTXQDAGOHRSI-UHFFFAOYSA-N
Mol Weight 287.28 g/mol
Molecular Formula C14H16F3NO2
Exact Mass 287.113313 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID Dm92YNn9a08
Name Pentedrone TFA
Classification Cathinone analog designer drug derivative
Comments Spectrum verified by independent measurements in external laboratories
Copyright Copyright © 2024 DigiLab GmbH and Wiley-VCH GmbH. All Rights Reserved.
Exact Mass 287.113313246 u
Formula C14H16F3NO2
InChI InChI=1S/C14H16F3NO2/c1-3-7-11(18(2)13(20)14(15,16)17)12(19)10-8-5-4-6-9-10/h4-6,8-9,11H,3,7H2,1-2H3
InChIKey ACGTXQDAGOHRSI-UHFFFAOYSA-N
Ionization Type Electron Ionization (EI)
Molecular Weight 287.282 g/mol
Nominal Mass 287 u
Quality 939
Retention Index 1563
SMILES C(N(C(C(F)(F)F)=O)C)(C(C1=CC=CC=C1)=O)CCC
SPLASH splash10-053u-3900000000-f7bef0f2ecf26fe9ef53
Source of Spectrum DigiLab GmbH (C) 2024
Synonyms 2-(N-Trifluoroacetyl-methylamino)-1-phenyl-pentan-1-one trifluoro-N-methyl-N-(1-oxo-1-phenylpentan-2-yl)acetamide
Technique GC/MS
Wiley ID DD2024_014339