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Naproxen, heptadecyl ester

View entire compound with spectra: 1 NMR

Naproxen, heptadecyl ester
SpectraBase Compound ID DnI5mH7lTnz
InChI InChI=1S/C31H48O3/c1-4-5-6-7-8-9-10-11-12-13-14-15-16-17-18-23-34-31(32)26(2)27-19-20-29-25-30(33-3)22-21-28(29)24-27/h19-22,24-26H,4-18,23H2,1-3H3
InChIKey NJTMVMNRHNOPKG-UHFFFAOYSA-N
Mol Weight 468.7 g/mol
Molecular Formula C31H48O3
Exact Mass 468.360345 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 315qVQmUDdj
Name Naproxen, heptadecyl ester
Comments Computed using HOSE algorithm
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Exact Mass 468.360345403 u
Formula C31H48O3
InChI InChI=1S/C31H48O3/c1-4-5-6-7-8-9-10-11-12-13-14-15-16-17-18-23-34-31(32)26(2)27-19-20-29-25-30(33-3)22-21-28(29)24-27/h19-22,24-26H,4-18,23H2,1-3H3
InChIKey NJTMVMNRHNOPKG-UHFFFAOYSA-N
Molecular Weight 468.722 g/mol
SMILES C1(=CC2=CC=C(C=C2C=C1)OC)C(C(OCCCCCCCCCCCCCCCCC)=O)C