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dl-Alanyl-dl-alanine, N,N'-methyl-N'-((1R)-(-)-menthyloxycarbonyl)-, (1R)-(-)-menthyl ester

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dl-Alanyl-dl-alanine, N,N'-methyl-N'-((1R)-(-)-menthyloxycarbonyl)-, (1R)-(-)-menthyl ester
SpectraBase Compound ID HWMhrmA4d3k
InChI InChI=1S/C29H52N2O5/c1-17(2)23-13-11-19(5)15-25(23)35-28(33)22(8)30(9)27(32)21(7)31(10)29(34)36-26-16-20(6)12-14-24(26)18(3)4/h17-26H,11-16H2,1-10H3
InChIKey PDPLDBGYHDWEJM-UHFFFAOYSA-N
Mol Weight 508.7 g/mol
Molecular Formula C29H52N2O5
Exact Mass 508.387623 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID IOymYdpv6yk
Name dl-Alanyl-dl-alanine, N,N'-methyl-N'-((1R)-(-)-menthyloxycarbonyl)-, (1R)-(-)-menthyl ester
Comments Computed using HOSE algorithm
Copyright Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 508.387622777 u
Formula C29H52N2O5
InChI InChI=1S/C29H52N2O5/c1-17(2)23-13-11-19(5)15-25(23)35-28(33)22(8)30(9)27(32)21(7)31(10)29(34)36-26-16-20(6)12-14-24(26)18(3)4/h17-26H,11-16H2,1-10H3
InChIKey PDPLDBGYHDWEJM-UHFFFAOYSA-N
Molecular Weight 508.744 g/mol
SMILES CN(C(C(=O)OC1C(C(C)C)CCC(C)C1)C)C(=O)C(N(C(OC1CC(C)CCC1C(C)C)=O)C)C