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5-Anilino-3-deuteriocarbomethoxy-2-dimethylsulfoximido-1,4-benzoquinone
SpectraBase Compound ID Gcbm2YkgAqa
InChI InChI=1S/C16H16N2O5S/c1-18(2)24(22)15-12(19)9-11(14(20)13(15)16(21)23-3)17-10-7-5-4-6-8-10/h4-9,17H,1-3H3/i3D3
InChIKey FEPDCUADEYIGFY-HPRDVNIFSA-N
Mol Weight 351.39 g/mol
Molecular Formula C16H132D3N2O5S
Exact Mass 351.096823 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID K0mgfxFcwZk
Name 5-Anilino-3-deuteriocarbomethoxy-2-dimethylsulfoximido-1,4-benzoquinone
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C16H13D3N2O5S
InChI InChI=1S/C16H16N2O5S/c1-18(2)24(22)15-12(19)9-11(14(20)13(15)16(21)23-3)17-10-7-5-4-6-8-10/h4-9,17H,1-3H3/i3D3
InChIKey FEPDCUADEYIGFY-HPRDVNIFSA-N
Molecular Weight 351.391 g/mol
SMILES N(C1=CC(C(=C(C1=O)C(=O)OC([2D])([2D])[2D])S(N(C)C)=O)=O)c1ccccc1
SPLASH splash10-0006-0901000000-a6fcb6a4948f8c39aebb
Source of Spectrum Y-22-709-5
Wiley ID 1340383