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N-Benzyl-3,4-methylenedioxycathinone TFA
SpectraBase Compound ID 65tJtQ7vaGq
InChI InChI=1S/C19H16F3NO4/c1-12(17(24)14-7-8-15-16(9-14)27-11-26-15)23(18(25)19(20,21)22)10-13-5-3-2-4-6-13/h2-9,12H,10-11H2,1H3
InChIKey JMAWUZAYYVADIG-UHFFFAOYSA-N
Mol Weight 379.34 g/mol
Molecular Formula C19H16F3NO4
Exact Mass 379.103142 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID GWfRE9IJ7lQ
Name N-Benzyl-3,4-methylenedioxycathinone TFA
Classification Cathinone analog designer drug derivative
Copyright Copyright © 2024 DigiLab GmbH and Wiley-VCH GmbH. All Rights Reserved.
Exact Mass 379.103142484 u
Formula C19H16F3NO4
InChI InChI=1S/C19H16F3NO4/c1-12(17(24)14-7-8-15-16(9-14)27-11-26-15)23(18(25)19(20,21)22)10-13-5-3-2-4-6-13/h2-9,12H,10-11H2,1H3
InChIKey JMAWUZAYYVADIG-UHFFFAOYSA-N
Ionization Type Electron Ionization (EI)
Molecular Weight 379.335 g/mol
Nominal Mass 379 u
Quality 988
Retention Index 2403
SMILES C(N(C(C(F)(F)F)=O)CC=1C=CC=CC1)(C(C=1C=C2C(=CC1)OCO2)=O)C
SPLASH splash10-0005-4900000000-e9edddb7586518cd4ad7
Source of Spectrum DigiLab GmbH (C) 2024
Synonyms N-(1-(1,3-benzodioxol-5-yl)-1-oxopropan-2-yl)-N-benzyltrifluoroacetamide
Technique GC/MS
Wiley ID DD2024_013174