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D-Prolyl-D-proline, N-(2-chloroethoxycarbonyl)-, isobutyl ester

View entire compound with spectra: 1 NMR

D-Prolyl-D-proline, N-(2-chloroethoxycarbonyl)-, isobutyl ester
SpectraBase Compound ID ADz7KtluJMZ
InChI InChI=1S/C17H27ClN2O5/c1-12(2)11-25-16(22)14-6-4-8-19(14)15(21)13-5-3-9-20(13)17(23)24-10-7-18/h12-14H,3-11H2,1-2H3
InChIKey XTQDBOXVCKVLKJ-UHFFFAOYSA-N
Mol Weight 374.87 g/mol
Molecular Formula C17H27ClN2O5
Exact Mass 374.16085 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID HFOiTllAmBZ
Name D-Prolyl-D-proline, N-(2-chloroethoxycarbonyl)-, isobutyl ester
Comments Computed using HOSE algorithm
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Exact Mass 374.160849672 u
Formula C17H27ClN2O5
InChI InChI=1S/C17H27ClN2O5/c1-12(2)11-25-16(22)14-6-4-8-19(14)15(21)13-5-3-9-20(13)17(23)24-10-7-18/h12-14H,3-11H2,1-2H3
InChIKey XTQDBOXVCKVLKJ-UHFFFAOYSA-N
Molecular Weight 374.865 g/mol
SMILES C1(N(CCC1)C(=O)C1N(C(OCCCl)=O)CCC1)C(OCC(C)C)=O