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Methyl 2-[(3-methylbutanoyl)amino]propanoate
SpectraBase Compound ID 5ozqPv9jNRI
InChI InChI=1S/C9H17NO3/c1-6(2)5-8(11)10-7(3)9(12)13-4/h6-7H,5H2,1-4H3,(H,10,11)
InChIKey WCOOHUBOOPVTSF-UHFFFAOYSA-N
Mol Weight 187.24 g/mol
Molecular Formula C9H17NO3
Exact Mass 187.120843 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID D6stmBk8BBN
Name Methyl 2-[(3-methylbutanoyl)amino]propanoate
Alternate Name(s) 2-(isovalerylamino)propionic acid methyl ester 2-[(3-methyl-1-oxobutyl)amino]propanoic acid methyl ester l-Alanine, N-(3-methyl-1-oxobutyl)-, methyl ester
CAS Registry Number 88127-27-9
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C9H17NO3
InChI InChI=1S/C9H17NO3/c1-6(2)5-8(11)10-7(3)9(12)13-4/h6-7H,5H2,1-4H3,(H,10,11)
InChIKey WCOOHUBOOPVTSF-UHFFFAOYSA-N
Molecular Weight 187.239 g/mol
SMILES N(C(CC(C)C)=O)C(C)C(=O)OC
SPLASH splash10-0006-9200000000-2c90f2d6dc75d143b2c3
Wiley ID 1499370