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L-Hydroxyprolylglycine, N,o-bis(butoxycarbonyl)-, butyl ester

View entire compound with spectra: 1 NMR

L-Hydroxyprolylglycine, N,o-bis(butoxycarbonyl)-, butyl ester
SpectraBase Compound ID KTVfKx298Gh
InChI InChI=1S/C21H36N2O8/c1-4-7-10-28-18(24)14-22-19(25)17-13-16(31-21(27)30-12-9-6-3)15-23(17)20(26)29-11-8-5-2/h16-17H,4-15H2,1-3H3,(H,22,25)
InChIKey RZTLAPWLXGGVQM-UHFFFAOYSA-N
Mol Weight 444.5 g/mol
Molecular Formula C21H36N2O8
Exact Mass 444.247166 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID GQZZr4khL2y
Name L-Hydroxyprolylglycine, N,o-bis(butoxycarbonyl)-, butyl ester
Comments Computed using HOSE algorithm
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Exact Mass 444.247166119 u
Formula C21H36N2O8
InChI InChI=1S/C21H36N2O8/c1-4-7-10-28-18(24)14-22-19(25)17-13-16(31-21(27)30-12-9-6-3)15-23(17)20(26)29-11-8-5-2/h16-17H,4-15H2,1-3H3,(H,22,25)
InChIKey RZTLAPWLXGGVQM-UHFFFAOYSA-N
Molecular Weight 444.525 g/mol
SMILES C(OC(=O)N1CC(OC(OCCCC)=O)CC1C(=O)NCC(OCCCC)=O)CCC