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1-ACETYL-3-HYDROXY-3-[1-(PHENYLSELENYL)-ETHYL]-2,5-PIPERAZINEDIONE,ISOMER-#A
SpectraBase Compound ID ICtL7oYXrot
InChI InChI=1S/C14H16N2O4Se/c1-9(21-11-6-4-3-5-7-11)14(20)13(19)16(10(2)17)8-12(18)15-14/h3-7,9,20H,8H2,1-2H3,(H,15,18)
InChIKey RMEDLAFQYQSUGI-UHFFFAOYSA-N
Mol Weight 355.26 g/mol
Molecular Formula C14H16N2O4Se
Exact Mass 356.027529 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID AoPhd12bOjI
Name 1-Acetyl-3-hydroxy-3-(1-phenylselanylethyl)piperazine-2,5-dione
Alternate Name(s) 1-Acetyl-3-hydroxy-3-[1-(phenylseleno)ethyl]piperazine-2,5-dione 1-Acetyl-3-hydroxy-3-[1-(phenylseleno)ethyl]piperazine-2,5-quinone 1-Ethanoyl-3-oxidanyl-3-(1-phenylselanylethyl)piperazine-2,5-dione
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Formula C14H16N2O4Se
InChI InChI=1S/C14H16N2O4Se/c1-9(21-11-6-4-3-5-7-11)14(20)13(19)16(10(2)17)8-12(18)15-14/h3-7,9,20H,8H2,1-2H3,(H,15,18)
InChIKey RMEDLAFQYQSUGI-UHFFFAOYSA-N
Molecular Weight 355.264 g/mol
SMILES N1C(CN(C(C1(C([Se]c1ccccc1)C)O)=O)C(=O)C)=O
SPLASH splash10-0bu0-0923000000-b487ce7a82213ecab365
Source of Spectrum J-57-3669-21
Wiley ID 1345522