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3-(2,5-diketopiperazino)propionic acid methyl ester
SpectraBase Compound ID I34Yv3nWk7H
InChI InChI=1S/C8H12N2O4/c1-14-8(13)2-3-10-5-6(11)9-4-7(10)12/h2-5H2,1H3,(H,9,11)
InChIKey MOZBBIVVLJOLJR-UHFFFAOYSA-N
Mol Weight 200.19 g/mol
Molecular Formula C8H12N2O4
Exact Mass 200.079707 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 6NI8st4saXU
Name 3-(2,5-diketopiperazino)propionic acid methyl ester
CAS Registry Number 106659-86-3
Comments Less than 3 mono-isotopic peaks
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Formula C8H12N2O4
InChI InChI=1S/C8H12N2O4/c1-14-8(13)2-3-10-5-6(11)9-4-7(10)12/h2-5H2,1H3,(H,9,11)
InChIKey MOZBBIVVLJOLJR-UHFFFAOYSA-N
Molecular Weight 200.194 g/mol
SMILES N1CC(N(CC1=O)CCC(=O)OC)=O
SPLASH splash10-0udi-0490000000-52fdd5d9a502ca563add
Source of Spectrum Y-23-231-4
Synonyms 3-(2,5-dioxo-1-piperazinyl)propanoic acid methyl ester methyl 3-(2,5-dioxopiperazin-1-yl)propanoate methyl 3-[2,5-bis(oxidanylidene)piperazin-1-yl]propanoate
Wiley ID 1197155