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Dibutyl 2-([2-(acetylamino)-3-methylbutanoyl]amino)pentanedioate
SpectraBase Compound ID 7jpXpsPB2oH
InChI InChI=1S/C20H36N2O6/c1-6-8-12-27-17(24)11-10-16(20(26)28-13-9-7-2)22-19(25)18(14(3)4)21-15(5)23/h14,16,18H,6-13H2,1-5H3,(H,21,23)(H,22,25)
InChIKey OHLPYPKZEDIARR-UHFFFAOYSA-N
Mol Weight 400.5 g/mol
Molecular Formula C20H36N2O6
Exact Mass 400.257337 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 4EDLbcB972
Name Dibutyl 2-([2-(acetylamino)-3-methylbutanoyl]amino)pentanedioate
CAS Registry Number 77536-49-3
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C20H36N2O6
InChI InChI=1S/C20H36N2O6/c1-6-8-12-27-17(24)11-10-16(20(26)28-13-9-7-2)22-19(25)18(14(3)4)21-15(5)23/h14,16,18H,6-13H2,1-5H3,(H,21,23)(H,22,25)
InChIKey OHLPYPKZEDIARR-UHFFFAOYSA-N
Molecular Weight 400.516 g/mol
SMILES N(C(CCC(OCCCC)=O)C(OCCCC)=O)C(C(C(C)C)NC(=O)C)=O
SPLASH splash10-096r-7900000000-dc8f73e2195761191cbb
Source of Spectrum W5-0-0-0
Synonyms 2-[(2-acetamido-3-methyl-1-oxobutyl)amino]pentanedioic acid dibutyl ester 2-[(2-acetamido-3-methyl-butanoyl)amino]glutaric acid dibutyl ester dibutyl 2-[(2-acetamido-3-methyl-butanoyl)amino]pentanedioate l-Glutamic acid, N-(N-acetyl-l-valyl)-, dibutyl ester
Wiley ID 1369310