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L-Proline, N-(1-naphthoyl)-, isohexyl ester

View entire compound with spectra: 1 NMR

L-Proline, N-(1-naphthoyl)-, isohexyl ester
SpectraBase Compound ID 403WURqi50K
InChI InChI=1S/C22H27NO3/c1-16(2)8-7-15-26-22(25)20-13-6-14-23(20)21(24)19-12-5-10-17-9-3-4-11-18(17)19/h3-5,9-12,16,20H,6-8,13-15H2,1-2H3
InChIKey OGFVEWSKIVZGPT-UHFFFAOYSA-N
Mol Weight 353.46 g/mol
Molecular Formula C22H27NO3
Exact Mass 353.199094 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 6o31CIja0F6
Name L-Proline, N-(1-naphthoyl)-, isohexyl ester
Comments Computed using HOSE algorithm
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Exact Mass 353.199093730 u
Formula C22H27NO3
InChI InChI=1S/C22H27NO3/c1-16(2)8-7-15-26-22(25)20-13-6-14-23(20)21(24)19-12-5-10-17-9-3-4-11-18(17)19/h3-5,9-12,16,20H,6-8,13-15H2,1-2H3
InChIKey OGFVEWSKIVZGPT-UHFFFAOYSA-N
Molecular Weight 353.462 g/mol
SMILES C1C(N(C(=O)C2=CC=CC3=C2C=CC=C3)CC1)C(=O)OCCCC(C)C