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L-Norleucyl-L-norleucine, N-propoxycarbonyl-, hexyl ester

View entire compound with spectra: 1 NMR

L-Norleucyl-L-norleucine, N-propoxycarbonyl-, hexyl ester
SpectraBase Compound ID G08omGdD8CU
InChI InChI=1S/C22H42N2O5/c1-5-9-12-13-17-28-21(26)19(15-11-7-3)23-20(25)18(14-10-6-2)24-22(27)29-16-8-4/h18-19H,5-17H2,1-4H3,(H,23,25)(H,24,27)
InChIKey PEGOSIZIOZCNNQ-UHFFFAOYSA-N
Mol Weight 414.6 g/mol
Molecular Formula C22H42N2O5
Exact Mass 414.309372 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID GKEH08jeBvf
Name L-Norleucyl-L-norleucine, N-propoxycarbonyl-, hexyl ester
Comments Computed using HOSE algorithm
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Exact Mass 414.309372455 u
Formula C22H42N2O5
InChI InChI=1S/C22H42N2O5/c1-5-9-12-13-17-28-21(26)19(15-11-7-3)23-20(25)18(14-10-6-2)24-22(27)29-16-8-4/h18-19H,5-17H2,1-4H3,(H,23,25)(H,24,27)
InChIKey PEGOSIZIOZCNNQ-UHFFFAOYSA-N
Molecular Weight 414.587 g/mol
SMILES CCCCCCOC(C(NC(C(NC(OCCC)=O)CCCC)=O)CCCC)=O