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(+-)-threo-6-(.alpha.-methoxybenzyl)-1,4-dimethylpiperazine-2,3,5-trione
SpectraBase Compound ID Ib5w2exh5wA
InChI InChI=1S/C14H16N2O4/c1-15-10(12(17)16(2)14(19)13(15)18)11(20-3)9-7-5-4-6-8-9/h4-8,10-11H,1-3H3
InChIKey IGPUGDDIBSCSPX-UHFFFAOYSA-N
Mol Weight 276.29 g/mol
Molecular Formula C14H16N2O4
Exact Mass 276.111007 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 7yIyid5F0Dr
Name (+-)-threo-6-(.alpha.-methoxybenzyl)-1,4-dimethylpiperazine-2,3,5-trione
Alternate Name(s) (+-)-erythro-6-(.alpha.-methoxybenzyl)-1,4-dimethylpiperazine-2,3,5-trione 6-[methoxy(phenyl)methyl]-1,4-dimethyl-2,3,5-piperazinetrione
CAS Registry Number 107199-35-9
Comments Less than 3 mono-isotopic peaks
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Formula C14H16N2O4
InChI InChI=1S/C14H16N2O4/c1-15-10(12(17)16(2)14(19)13(15)18)11(20-3)9-7-5-4-6-8-9/h4-8,10-11H,1-3H3
InChIKey IGPUGDDIBSCSPX-UHFFFAOYSA-N
Molecular Weight 276.292 g/mol
SMILES C1(C(N(C)C(C(N1C)=O)=O)=O)C(c1ccccc1)OC
SPLASH splash10-00di-0900000000-012eca988f049ad95696
Source of Spectrum B-38-1795-20
Wiley ID 1279899