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p-Hexadecyloxybenzoic acid

View entire compound with spectra: 1 NMR, 1 FTIR, 1 Raman, and 1 MS (GC)

p-Hexadecyloxybenzoic acid
SpectraBase Compound ID IGUTXrG0ONy
InChI InChI=1S/C23H38O3/c1-2-3-4-5-6-7-8-9-10-11-12-13-14-15-20-26-22-18-16-21(17-19-22)23(24)25/h16-19H,2-15,20H2,1H3,(H,24,25)
InChIKey GAQCVRTXIAGNEM-UHFFFAOYSA-N
Mol Weight 362.6 g/mol
Molecular Formula C23H38O3
Exact Mass 362.282095 g/mol

Raman Spectrum

Raman Spectrum

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SpectraBase Spectrum ID F3s2ytkElPO
Name p-(Hexadecyloxy)benzoic acid
Comments Computed using SmartSpectra Model v1.42
Copyright Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 362.282095081 u
Formula C23H38O3
InChI InChI=1S/C23H38O3/c1-2-3-4-5-6-7-8-9-10-11-12-13-14-15-20-26-22-18-16-21(17-19-22)23(24)25/h16-19H,2-15,20H2,1H3,(H,24,25)
InChIKey GAQCVRTXIAGNEM-UHFFFAOYSA-N
Molecular Weight 362.554 g/mol
SMILES OC(C=1C=CC(=CC1)OCCCCCCCCCCCCCCCC)=O
Spectrum/Structure Validation Score (Raman) 0.978178