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Alanylalanine, N,N'-dimethyl-N'-isobutoxycarbonyl-, isohexyl ester

View entire compound with spectra: 1 NMR

Alanylalanine, N,N'-dimethyl-N'-isobutoxycarbonyl-, isohexyl ester
SpectraBase Compound ID CaaRO2XxrUV
InChI InChI=1S/C19H36N2O5/c1-13(2)10-9-11-25-18(23)16(6)20(7)17(22)15(5)21(8)19(24)26-12-14(3)4/h13-16H,9-12H2,1-8H3
InChIKey OIWISWJAXNYBEX-UHFFFAOYSA-N
Mol Weight 372.5 g/mol
Molecular Formula C19H36N2O5
Exact Mass 372.262422 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 9OvFfq74i7c
Name Alanylalanine, N,N'-dimethyl-N'-isobutoxycarbonyl-, isohexyl ester
Comments Computed using HOSE algorithm
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Exact Mass 372.262422262 u
Formula C19H36N2O5
InChI InChI=1S/C19H36N2O5/c1-13(2)10-9-11-25-18(23)16(6)20(7)17(22)15(5)21(8)19(24)26-12-14(3)4/h13-16H,9-12H2,1-8H3
InChIKey OIWISWJAXNYBEX-UHFFFAOYSA-N
Molecular Weight 372.506 g/mol
SMILES CC(COC(N(C(C(N(C(C(OCCCC(C)C)=O)C)C)=O)C)C)=O)C