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L-Proline, N-(3-methylbenzoyl)-, pentadecyl ester

View entire compound with spectra: 1 NMR, and 1 FTIR

L-Proline, N-(3-methylbenzoyl)-, pentadecyl ester
SpectraBase Compound ID 8LGLpZJlNIo
InChI InChI=1S/C28H45NO3/c1-3-4-5-6-7-8-9-10-11-12-13-14-15-22-32-28(31)26-20-17-21-29(26)27(30)25-19-16-18-24(2)23-25/h16,18-19,23,26H,3-15,17,20-22H2,1-2H3
InChIKey QZQJEWZEVWGZOP-UHFFFAOYSA-N
Mol Weight 443.7 g/mol
Molecular Formula C28H45NO3
Exact Mass 443.339944 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 8mWyVHnoNwk
Name L-Proline, N-(3-methylbenzoyl)-, pentadecyl ester
Comments Computed using HOSE algorithm
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Exact Mass 443.339944310 u
Formula C28H45NO3
InChI InChI=1S/C28H45NO3/c1-3-4-5-6-7-8-9-10-11-12-13-14-15-22-32-28(31)26-20-17-21-29(26)27(30)25-19-16-18-24(2)23-25/h16,18-19,23,26H,3-15,17,20-22H2,1-2H3
InChIKey QZQJEWZEVWGZOP-UHFFFAOYSA-N
Molecular Weight 443.672 g/mol
SMILES C1(=CC=CC(=C1)C(N1CCCC1C(=O)OCCCCCCCCCCCCCCC)=O)C