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3-(2-Methylsulfanylethyl)piperazine-2,5-dione
SpectraBase Compound ID 47DxKkJpScX
InChI InChI=1S/C7H12N2O2S/c1-12-3-2-5-7(11)8-4-6(10)9-5/h5H,2-4H2,1H3,(H,8,11)(H,9,10)
InChIKey BYJGBWBCRKWFFX-UHFFFAOYSA-N
Mol Weight 188.25 g/mol
Molecular Formula C7H12N2O2S
Exact Mass 188.061949 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID BteKN7OYpKg
Name 3-(2-Methylsulfanylethyl)piperazine-2,5-dione
Alternate Name(s) 3-[2-(methylthio)ethyl]piperazine-2,5-dione 3-[2-(methylthio)ethyl]piperazine-2,5-quinone
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C7H12N2O2S
InChI InChI=1S/C7H12N2O2S/c1-12-3-2-5-7(11)8-4-6(10)9-5/h5H,2-4H2,1H3,(H,8,11)(H,9,10)
InChIKey BYJGBWBCRKWFFX-UHFFFAOYSA-N
Molecular Weight 188.245 g/mol
SMILES N1C(C(NCC1=O)=O)CCSC
SPLASH splash10-03fr-9400000000-0199288a6359d3414c19
Source of Spectrum M-32-391-4
Wiley ID 1184185