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Phthalic acid, nonyl pentadecyl ester

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

Phthalic acid, nonyl pentadecyl ester
SpectraBase Compound ID DvHzpMlOaOx
InChI InChI=1S/C32H54O4/c1-3-5-7-9-11-12-13-14-15-16-18-20-24-28-36-32(34)30-26-22-21-25-29(30)31(33)35-27-23-19-17-10-8-6-4-2/h21-22,25-26H,3-20,23-24,27-28H2,1-2H3
InChIKey YOXDXVQHZZHQAV-UHFFFAOYSA-N
Mol Weight 502.8 g/mol
Molecular Formula C32H54O4
Exact Mass 502.40221 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID DpVgatU5LRX
Name Phthalic acid, nonyl pentadecyl ester
Comments Computed using HOSE algorithm
Copyright Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 502.402210215 u
Formula C32H54O4
InChI InChI=1S/C32H54O4/c1-3-5-7-9-11-12-13-14-15-16-18-20-24-28-36-32(34)30-26-22-21-25-29(30)31(33)35-27-23-19-17-10-8-6-4-2/h21-22,25-26H,3-20,23-24,27-28H2,1-2H3
InChIKey YOXDXVQHZZHQAV-UHFFFAOYSA-N
Molecular Weight 502.780 g/mol
SMILES C1(=CC=CC=C1C(OCCCCCCCCCCCCCCC)=O)C(OCCCCCCCCC)=O