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N-ACETYL-L-ORNITHINYL-L-ALANINE-METHYLESTER-HYDROACETATE

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N-ACETYL-L-ORNITHINYL-L-ALANINE-METHYLESTER-HYDROACETATE
SpectraBase Compound ID 4m399Ha6E2u
InChI InChI=1S/C11H21N3O4.C2H4O2/c1-7(11(17)18-3)13-10(16)9(5-4-6-12)14-8(2)15;1-2(3)4/h7,9H,4-6,12H2,1-3H3,(H,13,16)(H,14,15);1H3,(H,3,4)/t7?,9-;/m1./s1
InChIKey FSPKPGXBKLMKOE-LJGVWRNTSA-N
Mol Weight 319.36 g/mol
Molecular Formula C13H25N3O6
Exact Mass 319.174336 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID DzNNA5Y7rz5
Name N-ACETYL-L-ORNITHINYL-L-ALANINE-METHYLESTER-HYDROACETATE
Compound Number 16
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C13H25N3O6
InChI InChI=1S/C11H21N3O4.C2H4O2/c1-7(11(17)18-3)13-10(16)9(5-4-6-12)14-8(2)15;1-2(3)4/h7,9H,4-6,12H2,1-3H3,(H,13,16)(H,14,15);1H3,(H,3,4)/t7?,9-;/m1./s1
InChIKey FSPKPGXBKLMKOE-LJGVWRNTSA-N
Literature Reference Author M.WEHNER,D.JANSSEN,G.SCHAEFER,T.SCHRADER
Literature Reference Citation EUR.J.ORG.CHEM.,138(2006)
Molecular Weight 319.358 g/mol
Sample ID 42733
Solvent CD3OD