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Methyl 2-[([(2-[acetyl(methyl)amino]-4-methylpentanoyl)(methyl)amino]acetyl)(methyl)amino]-3-phenylpropanoate
SpectraBase Compound ID IOIYvwyoj7S
InChI InChI=1S/C23H35N3O5/c1-16(2)13-19(25(5)17(3)27)22(29)24(4)15-21(28)26(6)20(23(30)31-7)14-18-11-9-8-10-12-18/h8-12,16,19-20H,13-15H2,1-7H3
InChIKey QBMSMPOASDVAML-UHFFFAOYSA-N
Mol Weight 433.5 g/mol
Molecular Formula C23H35N3O5
Exact Mass 433.257671 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID AIuY4sqmdYr
Name Methyl 2-[([(2-[acetyl(methyl)amino]-4-methylpentanoyl)(methyl)amino]acetyl)(methyl)amino]-3-phenylpropanoate
CAS Registry Number 77536-40-4
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C23H35N3O5
InChI InChI=1S/C23H35N3O5/c1-16(2)13-19(25(5)17(3)27)22(29)24(4)15-21(28)26(6)20(23(30)31-7)14-18-11-9-8-10-12-18/h8-12,16,19-20H,13-15H2,1-7H3
InChIKey QBMSMPOASDVAML-UHFFFAOYSA-N
Molecular Weight 433.549 g/mol
SMILES CC(C)CC(C(N(C)CC(N(C)C(Cc1ccccc1)C(=O)OC)=O)=O)N(C)C(C)=O
SPLASH splash10-0006-4910000000-422ad3395cf7b42ed913
Source of Spectrum W5-0-0-0
Synonyms 2-[[2-[[2-[acetyl(methyl)amino]-4-methyl-1-oxopentyl]-methylamino]-1-oxoethyl]-methylamino]-3-phenylpropanoic acid methyl ester 2-[[2-[[2-[acetyl(methyl)amino]-4-methyl-pentanoyl]-methyl-amino]acetyl]-methyl-amino]-3-phenyl-propionic acid methyl ester L-Phenylalanine, N-[N-(N-acetyl-N-methyl-L-leucyl)-N-methylglycyl]-N-methyl-, methyl ester Methyl 2-[2-[[2-[ethanoyl(methyl)amino]-4-methyl-pentanoyl]-methyl-amino]ethanoyl-methyl-amino]-3-phenyl-propanoate Methyl 2-[[2-[[2-[acetyl(methyl)amino]-4-methyl-pentanoyl]-methyl-amino]acetyl]-methyl-amino]-3-phenyl-propanoate
Wiley ID 1382668