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3-(4-Butyl-6-isopropyl-3,5-dioxo-piperazin-2-yl)-propionic acid 1-tert-butylcarbamoyl-2-methyl-propyl ester
SpectraBase Compound ID 79ZlQdTIbRF
InChI InChI=1S/C23H41N3O5/c1-13(2)17-21(30)26(23(8,9)10)20(29)15(24-17)11-12-16(27)31-18(14(3)4)19(28)25-22(5,6)7/h13-15,17-18,24H,11-12H2,1-10H3,(H,25,28)
InChIKey JDRULUWCCMHKNT-UHFFFAOYSA-N
Mol Weight 439.6 g/mol
Molecular Formula C23H41N3O5
Exact Mass 439.304621 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID IRRSVG2VubD
Name 3-(4-Butyl-6-isopropyl-3,5-dioxo-piperazin-2-yl)-propionic acid 1-tert-butylcarbamoyl-2-methyl-propyl ester
Comments Less than 3 mono-isotopic peaks
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Formula C23H41N3O5
InChI InChI=1S/C23H41N3O5/c1-13(2)17-21(30)26(23(8,9)10)20(29)15(24-17)11-12-16(27)31-18(14(3)4)19(28)25-22(5,6)7/h13-15,17-18,24H,11-12H2,1-10H3,(H,25,28)
InChIKey JDRULUWCCMHKNT-UHFFFAOYSA-N
Molecular Weight 439.597 g/mol
SMILES N1C(C(N(C(C1CCC(OC(C(NC(C)(C)C)=O)C(C)C)=O)=O)C(C)(C)C)=O)C(C)C
SPLASH splash10-0a4i-0009000000-653659b384f762e15ac6
Source of Spectrum F-52-11663-13
Synonyms 1-[(tert-butylamino)carbonyl]-2-methylpropyl 3-(4-butyl-6-isopropyl-3,5-dioxo-2-piperazinyl)propanoate 3-(4-Ter-butyl-6-isopropyl-3,5-dioxo-piperazin-2-yl)-propionic acid 1-tert-butylcarbamoyl-2-methyl-propyl ester N-Isopropylamido-2-methylpropyl 3-[1-Butyl-3-isopropyl-2,6-piperazinedione-5-yl]propanoate
Wiley ID 798721