2,3-Ethylone isomer

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Systematic / IUPAC Name: 1-(1,3-Benzodioxol-4-yl)-2-(ethylamino)-1-propanone (hydrochloride)

ID: Reference6073

Other Names: 1-(Benzo[d][1,3]dioxol-4-yl)-2-(ethylamino)propan-1-one, (monohydrochloride) ;
1-Propanone, 1-(1,3-benzodioxol-4-yl)-2-(ethylamino)-, (hydrochloride) ;
2,3-Ethylone isomer (hydrochloride);
2,3-bk-MDEA isomer

Formula: C12H15NO3

Class: Drugs of Abuse/Illegal Drugs

Spectral Data

2,3-Ethylone isomer mass spectral data can be found in a separate interface. The data are manually curated and of the highest quality.

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Available MS Data

Used Instruments Q Exactive Plus Orbitrap
No. of Spectral Trees 1
No. of Spectra 119
Tandem Spectra MS1, MS2
Ionization Methods ESI
Analyzers FT
Last Modification 11/23/2016 11:21:40 AM
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Identificators

InChI InChI=1S/C12H15NO3.ClH/c1-3-13-8(2)11(14)9-5-4-6-10-12(9)16-7-15-10;/h4-6,8,13H,3,7H2,1-2H3;1H
InChI Key NBKLIAKMVVIVEL-UHFFFAOYSA-N
Canonical SMILES O=C(C(C)NCC)C1=C(OCO2)C2=CC=C1.Cl
CAS
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Other Names 1-(Benzo[d][1,3]dioxol-4-yl)-2-(ethylamino)propan-1-one, (monohydrochloride) ;
1-Propanone, 1-(1,3-benzodioxol-4-yl)-2-(ethylamino)-, (hydrochloride) ;
2,3-Ethylone isomer (hydrochloride);
2,3-bk-MDEA isomer

In Other Databases

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