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D-Prolyl-D-proline, N-(2-chloroethoxycarbonyl-, hexyl ester

View entire compound with spectra: 1 NMR

D-Prolyl-D-proline, N-(2-chloroethoxycarbonyl-, hexyl ester
SpectraBase Compound ID Drm1kpCSXPE
InChI InChI=1S/C19H31ClN2O5/c1-2-3-4-5-13-26-18(24)16-9-7-11-21(16)17(23)15-8-6-12-22(15)19(25)27-14-10-20/h15-16H,2-14H2,1H3
InChIKey AYIOPFGQKTYVCP-UHFFFAOYSA-N
Mol Weight 402.92 g/mol
Molecular Formula C19H31ClN2O5
Exact Mass 402.19215 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID JJoHeN3JpZI
Name D-Prolyl-D-proline, N-(2-chloroethoxycarbonyl-, hexyl ester
Comments Computed using HOSE algorithm
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Exact Mass 402.192149801 u
Formula C19H31ClN2O5
InChI InChI=1S/C19H31ClN2O5/c1-2-3-4-5-13-26-18(24)16-9-7-11-21(16)17(23)15-8-6-12-22(15)19(25)27-14-10-20/h15-16H,2-14H2,1H3
InChIKey AYIOPFGQKTYVCP-UHFFFAOYSA-N
Molecular Weight 402.919 g/mol
SMILES C1(N(CCC1)C(=O)C1N(C(OCCCl)=O)CCC1)C(OCCCCCC)=O