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L-Proline, N-pentyl-, pentyl ester
SpectraBase Compound ID 7n0a7MTlHVd
InChI InChI=1S/C15H29NO2/c1-3-5-7-11-16-12-9-10-14(16)15(17)18-13-8-6-4-2/h14H,3-13H2,1-2H3
InChIKey KBBWMDCLOHERPW-UHFFFAOYSA-N
Mol Weight 255.4 g/mol
Molecular Formula C15H29NO2
Exact Mass 255.219829 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID BO9hNNaIbs9
Name L-Proline, N-pentyl-, pentyl ester
Comments Computed using HOSE algorithm
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Exact Mass 255.219829176 u
Formula C15H29NO2
InChI InChI=1S/C15H29NO2/c1-3-5-7-11-16-12-9-10-14(16)15(17)18-13-8-6-4-2/h14H,3-13H2,1-2H3
InChIKey KBBWMDCLOHERPW-UHFFFAOYSA-N
Molecular Weight 255.402 g/mol
SMILES C(OCCCCC)(=O)C1CCCN1CCCCC