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alpha-Bromo-3,4-methylenedioxyvalerophenone
SpectraBase Compound ID 7Xo899jRsUs
InChI InChI=1S/C12H13BrO3/c1-2-3-9(13)12(14)8-4-5-10-11(6-8)16-7-15-10/h4-6,9H,2-3,7H2,1H3
InChIKey FQBSUOHBUXPEHI-UHFFFAOYSA-N
Mol Weight 285.14 g/mol
Molecular Formula C12H13BrO3
Exact Mass 284.004807 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 8GgzMHUWiVE
Name alpha-Bromo-3,4-methylenedioxyvalerophenone
Classification Cathinone analog designer drug
Copyright Copyright © 2024 DigiLab GmbH and Wiley-VCH GmbH. All Rights Reserved.
Exact Mass 284.004807276 u
Formula C12H13BrO3
InChI InChI=1S/C12H13BrO3/c1-2-3-9(13)12(14)8-4-5-10-11(6-8)16-7-15-10/h4-6,9H,2-3,7H2,1H3
InChIKey FQBSUOHBUXPEHI-UHFFFAOYSA-N
Ionization Type Chemical Ionization (CI)
Molecular Weight 285.137 g/mol
Nominal Mass 284 u
Reagent Gas Methane
Retention Index 1926
SMILES C1=2C(=CC=C(C(C(CCC)Br)=O)C2)OCO1
SPLASH splash10-0a4r-0390000000-9a936986cc070bd0d027
Source of Spectrum DigiLab GmbH (C) 2024
Synonyms 1-(2H-1,3-Benzodioxol-5-yl)-2-bromopentan-1-one 2-Bromo-1-(3,4-methylenedioxyphenyl)pentan-1-one
Technique GC/MS
Wiley ID DD2024_020828