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L-Proline, N-(phenylacetyl)-, decyl ester
SpectraBase Compound ID 8bQ2dsfrnta
InChI InChI=1S/C23H35NO3/c1-2-3-4-5-6-7-8-12-18-27-23(26)21-16-13-17-24(21)22(25)19-20-14-10-9-11-15-20/h9-11,14-15,21H,2-8,12-13,16-19H2,1H3
InChIKey IUPXYGZZTOVBAV-UHFFFAOYSA-N
Mol Weight 373.5 g/mol
Molecular Formula C23H35NO3
Exact Mass 373.261694 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID HswkJX1Y84a
Name L-Proline, N-(phenylacetyl)-, decyl ester
Comments Computed using HOSE algorithm
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Exact Mass 373.261693988 u
Formula C23H35NO3
InChI InChI=1S/C23H35NO3/c1-2-3-4-5-6-7-8-12-18-27-23(26)21-16-13-17-24(21)22(25)19-20-14-10-9-11-15-20/h9-11,14-15,21H,2-8,12-13,16-19H2,1H3
InChIKey IUPXYGZZTOVBAV-UHFFFAOYSA-N
Molecular Weight 373.537 g/mol
SMILES C(C(N1CCCC1C(=O)OCCCCCCCCCC)=O)C1=CC=CC=C1