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Alanylalanylalanine, N,N',N''-trimethyl-N''-propoxycarbonyl-, ethyl ester

View entire compound with spectra: 1 NMR

Alanylalanylalanine, N,N',N''-trimethyl-N''-propoxycarbonyl-, ethyl ester
SpectraBase Compound ID 10Iy57m6fNB
InChI InChI=1S/C18H33N3O6/c1-9-11-27-18(25)21(8)13(4)16(23)19(6)12(3)15(22)20(7)14(5)17(24)26-10-2/h12-14H,9-11H2,1-8H3
InChIKey LRVKBNBHXBTHOH-UHFFFAOYSA-N
Mol Weight 387.5 g/mol
Molecular Formula C18H33N3O6
Exact Mass 387.236936 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID JEeerIRJ293
Name Alanylalanylalanine, N,N',N''-trimethyl-N''-propoxycarbonyl-, ethyl ester
Comments Computed using HOSE algorithm
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Exact Mass 387.236935789 u
Formula C18H33N3O6
InChI InChI=1S/C18H33N3O6/c1-9-11-27-18(25)21(8)13(4)16(23)19(6)12(3)15(22)20(7)14(5)17(24)26-10-2/h12-14H,9-11H2,1-8H3
InChIKey LRVKBNBHXBTHOH-UHFFFAOYSA-N
Molecular Weight 387.477 g/mol
SMILES CCCOC(N(C(C(N(C(C(N(C(C)C(OCC)=O)C)=O)C)C)=O)C)C)=O