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L-Leucine, N-[N-[N-(2-pyridinylmethylene)-L-leucyl]-L-leucyl]-, methyl ester
SpectraBase Compound ID 9g2MIm3VCVm
InChI InChI=1S/C25H40N4O4/c1-16(2)12-20(27-15-19-10-8-9-11-26-19)23(30)28-21(13-17(3)4)24(31)29-22(14-18(5)6)25(32)33-7/h8-11,15-18,20-22H,12-14H2,1-7H3,(H,28,30)(H,29,31)/b27-15+
InChIKey QYBKPHKIVLBXRY-JFLMPSFJSA-N
Mol Weight 460.6 g/mol
Molecular Formula C25H40N4O4
Exact Mass 460.304956 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID L9kJo3vr9Mr
Name L-Leucine, N-[N-[N-(2-pyridinylmethylene)-L-leucyl]-L-leucyl]-, methyl ester
Alternate Name(s) Methyl 4-methyl-2-((4-methyl-2-[(4-methyl-2-([(E)-2-pyridinylmethylidene]amino)pentanoyl)amino]pentanoyl)amino)pentanoate
CAS Registry Number 42547-80-8
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C25H40N4O4
InChI InChI=1S/C25H40N4O4/c1-16(2)12-20(27-15-19-10-8-9-11-26-19)23(30)28-21(13-17(3)4)24(31)29-22(14-18(5)6)25(32)33-7/h8-11,15-18,20-22H,12-14H2,1-7H3,(H,28,30)(H,29,31)/b27-15+
InChIKey QYBKPHKIVLBXRY-JFLMPSFJSA-N
Molecular Weight 460.619 g/mol
SMILES N(C(C(OC)=O)CC(C)C)C(C(CC(C)C)NC(=O)C(CC(C)C)\N=C\c1ccccn1)=O
SPLASH splash10-002r-0090000000-c79d68b61b198af7ce86
Source of Spectrum JZ-1992-2935-0
Wiley ID 1390488