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2-Ethylamino-1-(3,4-methylenedioxyphenyl)pentan-1-one TFA/A -2H
SpectraBase Compound ID HSwc3xQYkqN
InChI InChI=1S/C16H16F3NO4/c1-3-5-11(20(4-2)15(22)16(17,18)19)14(21)10-6-7-12-13(8-10)24-9-23-12/h5-8H,3-4,9H2,1-2H3/b11-5-
InChIKey ZKONSLDZCXEASZ-WZUFQYTHSA-N
Mol Weight 343.3 g/mol
Molecular Formula C16H16F3NO4
Exact Mass 343.103142 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 8FMASly3Mae
Name 2-Ethylamino-1-(3,4-methylenedioxyphenyl)pentan-1-one TFA/A -2H
Classification Cathinone analog designer drug derivative
Copyright Copyright © 2024 DigiLab GmbH and Wiley-VCH GmbH. All Rights Reserved.
Exact Mass 343.103142484 u
Formula C16H16F3NO4
InChI InChI=1S/C16H16F3NO4/c1-3-5-11(20(4-2)15(22)16(17,18)19)14(21)10-6-7-12-13(8-10)24-9-23-12/h5-8H,3-4,9H2,1-2H3/b11-5-
InChIKey ZKONSLDZCXEASZ-WZUFQYTHSA-N
Ionization Type Electron Ionization (EI)
Molecular Weight 343.302 g/mol
Nominal Mass 343 u
Quality 999
Retention Index 2094
SMILES C(N(\C(C(C=1C=C2C(=CC1)OCO2)=O)=C\CC)CC)(C(F)(F)F)=O
SPLASH splash10-0002-5910000000-b7ce31e131fb48eb6dbe
Sample Comments Double bond position uncertain
Source of Spectrum DigiLab GmbH (C) 2024
Synonyms N-Ethylpentylone TFA/A -2H NEP TFA/A -2H N-((2Z)-1-(1,3-benzodioxol-5-yl)-1-oxopent-2-en-2-yl)-N-ethyltrifluoroacetamide
Technique GC/MS
Wiley ID DD2024_014771