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D-Norleucyl-D-norleucine, N-butoxycarbonyl-, hexyl ester

View entire compound with spectra: 1 NMR

D-Norleucyl-D-norleucine, N-butoxycarbonyl-, hexyl ester
SpectraBase Compound ID 4S0wODgLZzn
InChI InChI=1S/C23H44N2O5/c1-5-9-13-14-18-29-22(27)20(16-11-7-3)24-21(26)19(15-10-6-2)25-23(28)30-17-12-8-4/h19-20H,5-18H2,1-4H3,(H,24,26)(H,25,28)
InChIKey ULQKJXWQGFYMSY-UHFFFAOYSA-N
Mol Weight 428.6 g/mol
Molecular Formula C23H44N2O5
Exact Mass 428.325023 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 4F9jhrgpwyZ
Name D-Norleucyl-D-norleucine, N-butoxycarbonyl-, hexyl ester
Comments Computed using HOSE algorithm
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Exact Mass 428.325022520 u
Formula C23H44N2O5
InChI InChI=1S/C23H44N2O5/c1-5-9-13-14-18-29-22(27)20(16-11-7-3)24-21(26)19(15-10-6-2)25-23(28)30-17-12-8-4/h19-20H,5-18H2,1-4H3,(H,24,26)(H,25,28)
InChIKey ULQKJXWQGFYMSY-UHFFFAOYSA-N
Molecular Weight 428.614 g/mol
SMILES C(OCCCC)(NC(C(NC(CCCC)C(OCCCCCC)=O)=O)CCCC)=O