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Butyl 2-([2-(acetylamino)-3-phenylpropanoyl]amino)-3-methylbutanoate
SpectraBase Compound ID 8utl9kWzHjb
InChI InChI=1S/C20H30N2O4/c1-5-6-12-26-20(25)18(14(2)3)22-19(24)17(21-15(4)23)13-16-10-8-7-9-11-16/h7-11,14,17-18H,5-6,12-13H2,1-4H3,(H,21,23)(H,22,24)
InChIKey RJNLGXGFDYLZRS-UHFFFAOYSA-N
Mol Weight 362.47 g/mol
Molecular Formula C20H30N2O4
Exact Mass 362.220557 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID GNKNUF8bWNt
Name Butyl 2-([2-(acetylamino)-3-phenylpropanoyl]amino)-3-methylbutanoate
Alternate Name(s) 2-[(2-acetamido-1-oxo-3-phenylpropyl)amino]-3-methylbutanoic acid butyl ester 2-[(2-acetamido-3-phenyl-propanoyl)amino]-3-methyl-butyric acid butyl ester Butyl 2-[(2-acetamido-3-phenyl-propanoyl)amino]-3-methyl-butanoate L-Valine, N-(N-acetyl-L-phenylalanyl)-, butyl ester
CAS Registry Number 77536-48-2
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C20H30N2O4
InChI InChI=1S/C20H30N2O4/c1-5-6-12-26-20(25)18(14(2)3)22-19(24)17(21-15(4)23)13-16-10-8-7-9-11-16/h7-11,14,17-18H,5-6,12-13H2,1-4H3,(H,21,23)(H,22,24)
InChIKey RJNLGXGFDYLZRS-UHFFFAOYSA-N
Molecular Weight 362.470 g/mol
SMILES N(C(C(C)C)C(=O)OCCCC)C(C(Cc1ccccc1)NC(C)=O)=O
SPLASH splash10-00ec-7910000000-45ae9fabfc939221d99f
Source of Spectrum W5-0-0-0
Wiley ID 1349639