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

*Links on SpectraBase are not permalinks.
2-Ethylamino-1-(3,4-methylenedioxyphenyl)pentan-1-one PFP/A -2H
SpectraBase Compound ID 36DPMbxMhQT
InChI InChI=1S/C17H16F5NO4/c1-3-5-11(23(4-2)15(25)16(18,19)17(20,21)22)14(24)10-6-7-12-13(8-10)27-9-26-12/h5-8H,3-4,9H2,1-2H3/b11-5-
InChIKey WNGRQWKWLFLREL-WZUFQYTHSA-N
Mol Weight 393.31 g/mol
Molecular Formula C17H16F5NO4
Exact Mass 393.099949 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 DkXKdVimPQm
Name 2-Ethylamino-1-(3,4-methylenedioxyphenyl)pentan-1-one PFP/A -2H
Classification Cathinone analog designer drug derivative
Copyright Copyright © 2024 DigiLab GmbH and Wiley-VCH GmbH. All Rights Reserved.
Exact Mass 393.099948810 u
Formula C17H16F5NO4
InChI InChI=1S/C17H16F5NO4/c1-3-5-11(23(4-2)15(25)16(18,19)17(20,21)22)14(24)10-6-7-12-13(8-10)27-9-26-12/h5-8H,3-4,9H2,1-2H3/b11-5-
InChIKey WNGRQWKWLFLREL-WZUFQYTHSA-N
Ionization Type Electron Ionization (EI)
Molecular Weight 393.310 g/mol
Nominal Mass 393 u
Quality 863
Retention Index 2060
SMILES C(C(N(\C(C(C=1C=C2C(=CC1)OCO2)=O)=C\CC)CC)=O)(C(F)(F)F)(F)F
SPLASH splash10-0002-5910000000-fa60de04449be0a415eb
Sample Comments Double bond position uncertain
Source of Spectrum DigiLab GmbH (C) 2024
Synonyms N-Ethylpentylone PFP/A -2H NEP PFP/A -2H N-(1-(1,3-benzodioxol-5-yl)-1-oxopent-2-en-2-yl)-N-ethyl-2,2,3,3,3-pentafluoropropanamide
Technique GC/MS
Wiley ID DD2024_014773