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Butyl 2-([2-(acetylamino)-4-methylpentanoyl]amino)-4-(methylsulfanyl)butanoate
SpectraBase Compound ID 8gu579DH7q6
InChI InChI=1S/C17H32N2O4S/c1-6-7-9-23-17(22)14(8-10-24-5)19-16(21)15(11-12(2)3)18-13(4)20/h12,14-15H,6-11H2,1-5H3,(H,18,20)(H,19,21)
InChIKey LOSFLQSMRJSHNF-UHFFFAOYSA-N
Mol Weight 360.5 g/mol
Molecular Formula C17H32N2O4S
Exact Mass 360.208279 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 6jspJHM5Bme
Name Butyl 2-([2-(acetylamino)-4-methylpentanoyl]amino)-4-(methylsulfanyl)butanoate
CAS Registry Number 77536-45-9
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C17H32N2O4S
InChI InChI=1S/C17H32N2O4S/c1-6-7-9-23-17(22)14(8-10-24-5)19-16(21)15(11-12(2)3)18-13(4)20/h12,14-15H,6-11H2,1-5H3,(H,18,20)(H,19,21)
InChIKey LOSFLQSMRJSHNF-UHFFFAOYSA-N
Molecular Weight 360.513 g/mol
SMILES N(C(CCSC)C(OCCCC)=O)C(C(CC(C)C)NC(=O)C)=O
SPLASH splash10-002u-9410000000-1355bf643dc416687bff
Source of Spectrum W5-0-0-0
Synonyms 2-[(2-acetamido-4-methyl-1-oxopentyl)amino]-4-(methylthio)butanoic acid butyl ester 2-[(2-acetamido-4-methyl-pentanoyl)amino]-4-(methylthio)butyric acid butyl ester Butyl 2-[(2-acetamido-4-methyl-pentanoyl)amino]-4-methylsulfanyl-butanoate L-Methionine, N-(N-acetyl-L-leucyl)-, butyl ester
Wiley ID 1348142