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Naproxen, hexadecyl ester

View entire compound with spectra: 1 NMR

Naproxen, hexadecyl ester
SpectraBase Compound ID HQBdVTjHquL
InChI InChI=1S/C30H46O3/c1-4-5-6-7-8-9-10-11-12-13-14-15-16-17-22-33-30(31)25(2)26-18-19-28-24-29(32-3)21-20-27(28)23-26/h18-21,23-25H,4-17,22H2,1-3H3
InChIKey VDXKWVDVEMUXNL-UHFFFAOYSA-N
Mol Weight 454.7 g/mol
Molecular Formula C30H46O3
Exact Mass 454.344695 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 3iAywq6pt35
Name Naproxen, hexadecyl ester
Comments Computed using HOSE algorithm
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Exact Mass 454.344695338 u
Formula C30H46O3
InChI InChI=1S/C30H46O3/c1-4-5-6-7-8-9-10-11-12-13-14-15-16-17-22-33-30(31)25(2)26-18-19-28-24-29(32-3)21-20-27(28)23-26/h18-21,23-25H,4-17,22H2,1-3H3
InChIKey VDXKWVDVEMUXNL-UHFFFAOYSA-N
Molecular Weight 454.695 g/mol
SMILES C1(=CC2=CC=C(C=C2C=C1)OC)C(C(OCCCCCCCCCCCCCCCC)=O)C