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Alanine, N-(2,2-diethyl-3-oxo-.beta.-alanyl)-2-methyl-, methyl ester
SpectraBase Compound ID 9kaQb1w41R5
InChI InChI=1S/C12H22N2O4/c1-6-12(7-2,8(13)15)9(16)14-11(3,4)10(17)18-5/h6-7H2,1-5H3,(H2,13,15)(H,14,16)
InChIKey HGLVYLCARUUUMT-UHFFFAOYSA-N
Mol Weight 258.32 g/mol
Molecular Formula C12H22N2O4
Exact Mass 258.157957 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID Jp7TZms25Yp
Name Alanine, N-(2,2-diethyl-3-oxo-.beta.-alanyl)-2-methyl-, methyl ester
CAS Registry Number 77919-08-5
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C12H22N2O4
InChI InChI=1S/C12H22N2O4/c1-6-12(7-2,8(13)15)9(16)14-11(3,4)10(17)18-5/h6-7H2,1-5H3,(H2,13,15)(H,14,16)
InChIKey HGLVYLCARUUUMT-UHFFFAOYSA-N
Molecular Weight 258.318 g/mol
SMILES N(C(C(C(=O)N)(CC)CC)=O)C(C(=O)OC)(C)C
SPLASH splash10-0aov-9400000000-9f47ee338becad2aa110
Source of Spectrum H-68-471-8
Synonyms Methyl 2-{[2-(aminocarbonyl)-2-ethylbutanoyl]amino}-2-methylpropanoate N-(1-methoxycarbonyl-1-methylathyl)-2,2-diathylmalonamid
Wiley ID 1261458