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Butylone
SpectraBase Compound ID ISoUWBATi4p
InChI InChI=1S/C12H15NO3/c1-3-9(13-2)12(14)8-4-5-10-11(6-8)16-7-15-10/h4-6,9,13H,3,7H2,1-2H3
InChIKey CGKQZIULZRXRRJ-UHFFFAOYSA-N
Mol Weight 221.26 g/mol
Molecular Formula C12H15NO3
Exact Mass 221.105193 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 8JCbWKKNgie
Name Butylone
CAS Registry Number 17762-90-2
Classification Designer drug analog, entactogene
Comments Spectrum verified by independent measurements in external laboratories
Copyright Copyright © 2024 DigiLab GmbH and Wiley-VCH GmbH. All Rights Reserved.
DEA Citation 21 CFR §1308.11 (d) (62)
DEA Controlled Substance Name 1-(1,3-Benzodioxol-5-yl)-2-(methylamino)butan-1-one
DEA Controlled Substance Type Salts, isomers (whether optical, position, or geometric), and salts of such isomers
DEA Controlled Substances Code Number 7541
DEA Schedule Schedule I
DEA Section Hallucinogenic substances. Unless specifically excepted or unless listed in another schedule, any material, compound, mixture, or preparation, which contains any quantity of the following hallucinogenic substances, or which contains any of its salts, isomers, and salts of isomers whenever the existence of such salts, isomers, and salts of isomers is possible within the specific chemical designation (for purposes of this paragraph only, the term "isomer" includes the optical, position and geometric isomers)
Exact Mass 221.105193344 u
Formula C12H15NO3
InChI InChI=1S/C12H15NO3/c1-3-9(13-2)12(14)8-4-5-10-11(6-8)16-7-15-10/h4-6,9,13H,3,7H2,1-2H3
InChIKey CGKQZIULZRXRRJ-UHFFFAOYSA-N
Ionization Type Electron Ionization (EI)
Molecular Weight 221.256 g/mol
Nominal Mass 221 u
Quality 929
Retention Index 1730
SMILES C=1(C(C(NC)CC)=O)C=C2C(=CC1)OCO2
SPLASH splash10-00di-9000000000-cd13cafda1c5f10e31ba
Source of Spectrum DigiLab GmbH (C) 2024
Synonyms Mebylone bk-MBDB 2-Methylamino-1-(3,4-methylenedioxyphenyl)butan-1-one
Technique GC/MS
Wiley ID DD2024_013739