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Alanylalanylalanine, N,N',N''-trimethyl-N''-ethoxycarbonyl-, propyl ester

View entire compound with spectra: 1 NMR

Alanylalanylalanine, N,N',N''-trimethyl-N''-ethoxycarbonyl-, propyl ester
SpectraBase Compound ID AX1imuex22Q
InChI InChI=1S/C18H33N3O6/c1-9-11-27-17(24)14(5)20(7)15(22)12(3)19(6)16(23)13(4)21(8)18(25)26-10-2/h12-14H,9-11H2,1-8H3
InChIKey QAUSQMBYOKLWPL-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 Gk6IsYDDng1
Name Alanylalanylalanine, N,N',N''-trimethyl-N''-ethoxycarbonyl-, propyl ester
Comments Computed using HOSE algorithm
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Exact Mass 387.236935789 u
Formula C18H33N3O6
InChI InChI=1S/C18H33N3O6/c1-9-11-27-17(24)14(5)20(7)15(22)12(3)19(6)16(23)13(4)21(8)18(25)26-10-2/h12-14H,9-11H2,1-8H3
InChIKey QAUSQMBYOKLWPL-UHFFFAOYSA-N
Molecular Weight 387.477 g/mol
SMILES CCOC(N(C(C(N(C(C(N(C(C)C(OCCC)=O)C)=O)C)C)=O)C)C)=O