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L-Proline, N-(thiophen-2-carbonyl)-, tetradecyl ester

View entire compound with spectra: 1 NMR

L-Proline, N-(thiophen-2-carbonyl)-, tetradecyl ester
SpectraBase Compound ID LGM4OES1P6q
InChI InChI=1S/C24H39NO3S/c1-2-3-4-5-6-7-8-9-10-11-12-13-19-28-24(27)21-16-14-18-25(21)23(26)22-17-15-20-29-22/h15,17,20-21H,2-14,16,18-19H2,1H3
InChIKey DDXODEDIFGHCJA-UHFFFAOYSA-N
Mol Weight 421.6 g/mol
Molecular Formula C24H39NO3S
Exact Mass 421.265065 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID GSjdPZuAAPz
Name L-Proline, N-(thiophen-2-carbonyl)-, tetradecyl ester
Comments Computed using HOSE algorithm
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Exact Mass 421.265065291 u
Formula C24H39NO3S
InChI InChI=1S/C24H39NO3S/c1-2-3-4-5-6-7-8-9-10-11-12-13-19-28-24(27)21-16-14-18-25(21)23(26)22-17-15-20-29-22/h15,17,20-21H,2-14,16,18-19H2,1H3
InChIKey DDXODEDIFGHCJA-UHFFFAOYSA-N
Molecular Weight 421.640 g/mol
SMILES CCCCCCCCCCCCCCOC(C1N(C(C=2SC=CC2)=O)CCC1)=O