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Butylone TFA
SpectraBase Compound ID 2TdjFwnoEW3
InChI InChI=1S/C14H14F3NO4/c1-3-9(18(2)13(20)14(15,16)17)12(19)8-4-5-10-11(6-8)22-7-21-10/h4-6,9H,3,7H2,1-2H3
InChIKey VEQTZIYKIZGHGF-UHFFFAOYSA-N
Mol Weight 317.26 g/mol
Molecular Formula C14H14F3NO4
Exact Mass 317.087492 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 4REbeiACe8w
Name Butylone 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 317.087492420 u
Formula C14H14F3NO4
InChI InChI=1S/C14H14F3NO4/c1-3-9(18(2)13(20)14(15,16)17)12(19)8-4-5-10-11(6-8)22-7-21-10/h4-6,9H,3,7H2,1-2H3
InChIKey VEQTZIYKIZGHGF-UHFFFAOYSA-N
Ionization Type Electron Ionization (EI)
Molecular Weight 317.264 g/mol
Nominal Mass 317 u
Quality 994
Retention Index 1815
SMILES C(C(C=1C=C2C(=CC1)OCO2)=O)(N(C(C(F)(F)F)=O)C)CC
SPLASH splash10-00ke-9600000000-b514a2282deec98b253a
Source of Spectrum DigiLab GmbH (C) 2024
Synonyms bk-BDB TFA N-(1-(1,3-benzodioxol-5-yl)-1-oxobutan-2-yl)(trifluoro)-N-methylacetamide
Technique GC/MS
Wiley ID DD2024_005709