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Glutaric acid, 4-acetylphenyl tetradecyl ester

View entire compound with spectra: 1 NMR

Glutaric acid, 4-acetylphenyl tetradecyl ester
SpectraBase Compound ID 5ATfrc7d0LD
InChI InChI=1S/C27H42O5/c1-3-4-5-6-7-8-9-10-11-12-13-14-22-31-26(29)16-15-17-27(30)32-25-20-18-24(19-21-25)23(2)28/h18-21H,3-17,22H2,1-2H3
InChIKey YQAYMANGMIDSEB-UHFFFAOYSA-N
Mol Weight 446.6 g/mol
Molecular Formula C27H42O5
Exact Mass 446.303224 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 5a9uorpw6lw
Name Glutaric acid, 4-acetylphenyl tetradecyl ester
Comments Computed using HOSE algorithm
Copyright Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 446.303224447 u
Formula C27H42O5
InChI InChI=1S/C27H42O5/c1-3-4-5-6-7-8-9-10-11-12-13-14-22-31-26(29)16-15-17-27(30)32-25-20-18-24(19-21-25)23(2)28/h18-21H,3-17,22H2,1-2H3
InChIKey YQAYMANGMIDSEB-UHFFFAOYSA-N
Molecular Weight 446.628 g/mol
SMILES CCCCCCCCCCCCCCOC(CCCC(OC1=CC=C(C=C1)C(=O)C)=O)=O