Pentedrone

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Systematic / IUPAC Name: 2-(Methylamino)-1-phenylpentan-1-one

ID: Reference2427

Other Names: 1-Pentanone, 2-(methylamino)?-1-phenyl- ;
α-Methylamino-valerophenone

Formula: C12H17NO

Class: Drugs of Abuse/Illegal Drugs Sports Doping Drugs

Spectral Data

Pentedrone 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 3
No. of Spectra 274
Tandem Spectra MS1, MS2
Ionization Methods ESI
Analyzers FT
Last Modification 11/20/2018 1:02:00 PM
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Identificators

InChI InChI=1S/C12H17NO/c1-3-7-11(13-2)12(14)10-8-5-4-6-9-10/h4-6,8-9,11,13H,3,7H2,1-2H3
InChI Key WLIWIUNEJRETFX-UHFFFAOYSA-N
Canonical SMILES CCCC(C(=O)C1=CC=CC=C1)NC
CAS
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Other Names 1-Pentanone, 2-(methylamino)?-1-phenyl- ;
α-Methylamino-valerophenone

In Other Databases

ChemSpider 26286729
Wikipedia Pentedrone
PubChem 57501499