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Dibutyl 2-([2-(acetylamino)-4-methylpentanoyl]amino)pentanedioate
SpectraBase Compound ID 1BWnr4jqUkX
InChI InChI=1S/C21H38N2O6/c1-6-8-12-28-19(25)11-10-17(21(27)29-13-9-7-2)23-20(26)18(14-15(3)4)22-16(5)24/h15,17-18H,6-14H2,1-5H3,(H,22,24)(H,23,26)
InChIKey WAZMEIVFNQBWBM-UHFFFAOYSA-N
Mol Weight 414.5 g/mol
Molecular Formula C21H38N2O6
Exact Mass 414.272987 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 9BuFwFFUzUD
Name Dibutyl 2-([2-(acetylamino)-4-methylpentanoyl]amino)pentanedioate
Alternate Name(s) 2-[(2-acetamido-4-methyl-1-oxopentyl)amino]pentanedioic acid dibutyl ester 2-[(2-acetamido-4-methyl-pentanoyl)amino]glutaric acid dibutyl ester dibutyl 2-[(2-acetamido-4-methyl-pentanoyl)amino]pentanedioate L-Glutamic acid, N-(N-acetyl-L-leucyl)-, dibutyl ester
CAS Registry Number 77536-52-8
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C21H38N2O6
InChI InChI=1S/C21H38N2O6/c1-6-8-12-28-19(25)11-10-17(21(27)29-13-9-7-2)23-20(26)18(14-15(3)4)22-16(5)24/h15,17-18H,6-14H2,1-5H3,(H,22,24)(H,23,26)
InChIKey WAZMEIVFNQBWBM-UHFFFAOYSA-N
Molecular Weight 414.543 g/mol
SMILES N(C(CCC(OCCCC)=O)C(OCCCC)=O)C(C(CC(C)C)NC(=O)C)=O
SPLASH splash10-004r-7901000000-229956a50238fc338152
Source of Spectrum W5-0-0-0
Wiley ID 1375311