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3-Acetylthio-1,4-dimethylpiperazine-2,5-dione
SpectraBase Compound ID 5SEMmBkZsEB
InChI InChI=1S/C8H12N2O3S/c1-5(11)14-8-7(13)9(2)4-6(12)10(8)3/h8H,4H2,1-3H3
InChIKey XGSZKQBYBIXSGG-UHFFFAOYSA-N
Mol Weight 216.25 g/mol
Molecular Formula C8H12N2O3S
Exact Mass 216.056863 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID JFtcCKarcNm
Name 3-Acetylthio-1,4-dimethylpiperazine-2,5-dione
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C8H12N2O3S
InChI InChI=1S/C8H12N2O3S/c1-5(11)14-8-7(13)9(2)4-6(12)10(8)3/h8H,4H2,1-3H3
InChIKey XGSZKQBYBIXSGG-UHFFFAOYSA-N
Molecular Weight 216.255 g/mol
SMILES C1(N(C(=O)CN(C1=O)C)C)SC(=O)C
SPLASH splash10-03dl-0900000000-5a793b77658ed0293549
Source of Spectrum B-46-1743-0
Synonyms S-(1,4-dimethyl-3,6-dioxo-2-piperazinyl) ethanethioate
Wiley ID 1214987