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4-[2-(Ethoxycarbonyl)ethyl]-3,3-dimethyl-5,5-([(2)H3]methyl)-1-pyrrolodine N-Oxide
SpectraBase Compound ID 6bfn9jjYf4C
InChI InChI=1S/C13H23NO3/c1-6-17-11(15)8-7-10-12(2,3)9-14(16)13(10,4)5/h9-10H,6-8H2,1-5H3/i4D3,5D3
InChIKey UMAGJLHTPFSFCN-RKAHMFOGSA-N
Mol Weight 247.37 g/mol
Molecular Formula C13H172D6NO3
Exact Mass 247.205454 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID QPbbfaOwoA
Name 4-[2-(Ethoxycarbonyl)ethyl]-3,3-dimethyl-5,5-([(2)H3]methyl)-1-pyrrolodine N-Oxide
CAS Registry Number 139461-58-8
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C13H17D6NO3
InChI InChI=1S/C13H23NO3/c1-6-17-11(15)8-7-10-12(2,3)9-14(16)13(10,4)5/h9-10H,6-8H2,1-5H3/i4D3,5D3
InChIKey UMAGJLHTPFSFCN-RKAHMFOGSA-N
Molecular Weight 247.368 g/mol
SMILES C1([N+](=CC(C1CCC(=O)OCC)(C)C)[O-])(C([2D])([2D])[2D])C([2D])([2D])[2D]
SPLASH splash10-0005-0950000000-02df76cc91df33d7788c
Source of Spectrum J-57-2301-7
Wiley ID 1244100