For citations & permissions, please see: Citations & Permissions - Wiley Science Solutions*

*Links on SpectraBase are not permalinks.
2-Methyl-4,5-methylenedioxypyrovalerone-A (-2H)
SpectraBase Compound ID 446CyU7M5L6
InChI InChI=1S/C17H21NO3/c1-3-6-14(18-7-4-5-8-18)17(19)13-10-16-15(9-12(13)2)20-11-21-16/h6,9-10H,3-5,7-8,11H2,1-2H3/b14-6-
InChIKey JJDSAXQZLLSUOW-NSIKDUERSA-N
Mol Weight 287.36 g/mol
Molecular Formula C17H21NO3
Exact Mass 287.152144 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

View the Full Spectrum for FREE!

The full spectrum can only be viewed using a FREE account.

SpectraBase Spectrum ID 8I9mKzHdD6W
Name 2-Methyl-4,5-methylenedioxypyrovalerone-A (-2H)
Classification Designer drug artifact
Copyright Copyright © 2024 DigiLab GmbH and Wiley-VCH GmbH. All Rights Reserved.
Exact Mass 287.152143537 u
Formula C17H21NO3
InChI InChI=1S/C17H21NO3/c1-3-6-14(18-7-4-5-8-18)17(19)13-10-16-15(9-12(13)2)20-11-21-16/h6,9-10H,3-5,7-8,11H2,1-2H3/b14-6-
InChIKey JJDSAXQZLLSUOW-NSIKDUERSA-N
Ionization Type Electron Ionization (EI)
Molecular Weight 287.359 g/mol
Nominal Mass 287 u
Quality 956
Retention Index 2209
SMILES C1(C(\C(N2CCCC2)=C\CC)=O)=C(C=C2C(=C1)OCO2)C
SPLASH splash10-00di-4930000000-b40100358c74762de6e8
Source of Spectrum DigiLab GmbH (C) 2024
Synonyms 1-(6-Methyl-2H-1,3-benzodioxol-5-yl)-2-(pyrrolidin-1-yl)pent-2-en-1-one
Technique GC/MS
Wiley ID DD2024_020820