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1-(4-Methylpiperidin-1-yl)hexane-1,2-dione
SpectraBase Compound ID HoJhGvQvy9G
InChI InChI=1S/C12H21NO2/c1-3-4-5-11(14)12(15)13-8-6-10(2)7-9-13/h10H,3-9H2,1-2H3
InChIKey BVMUUABEVWRWTR-UHFFFAOYSA-N
Mol Weight 211.3 g/mol
Molecular Formula C12H21NO2
Exact Mass 211.157229 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 5XYj2pIeQbi
Name 1-(4-Methylpiperidin-1-yl)hexane-1,2-dione
Appearance Colorless oil
Carrier Gas Argon
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 211.157228918 u
Formula C12H21NO2
InChI InChI=1S/C12H21NO2/c1-3-4-5-11(14)12(15)13-8-6-10(2)7-9-13/h10H,3-9H2,1-2H3
InChIKey BVMUUABEVWRWTR-UHFFFAOYSA-N
Instrument Name AMD 402
Ionization Type EI
Literature Reference DOI 10.1002/anie.202200062
Molecular Weight 211.305 g/mol
Quality 155
Reported Formula C12H21NO2
SMILES C(C(CCCC)=O)(=O)N1CCC(CC1)C
SPLASH splash10-004i-8910000000-9df6906380a16f65e2fb
Source of Spectrum ACI-61-SM21-3ac (DOI: 10.1002/anie.202200062)
Thin-Layer Chromatography 0.3 (pentane/EA, 10:1)
Wiley ID 1897567