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D-Proline, N-(2-chloroethoxycarbonyl)-, pentyl ester
SpectraBase Compound ID 6oVGiu3QbpV
InChI InChI=1S/C13H22ClNO4/c1-2-3-4-9-18-12(16)11-6-5-8-15(11)13(17)19-10-7-14/h11H,2-10H2,1H3
InChIKey XHGLGGQXGIXCIS-UHFFFAOYSA-N
Mol Weight 291.77 g/mol
Molecular Formula C13H22ClNO4
Exact Mass 291.123736 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID Bdxb4zpITmX
Name D-Proline, N-(2-chloroethoxycarbonyl)-, pentyl ester
Comments Computed using HOSE algorithm
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Exact Mass 291.123735888 u
Formula C13H22ClNO4
InChI InChI=1S/C13H22ClNO4/c1-2-3-4-9-18-12(16)11-6-5-8-15(11)13(17)19-10-7-14/h11H,2-10H2,1H3
InChIKey XHGLGGQXGIXCIS-UHFFFAOYSA-N
SMILES C1CCC(N1C(=O)OCCCl)C(=O)OCCCCC