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Phenol, 3-hexadecyl-

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

Phenol, 3-hexadecyl-
SpectraBase Compound ID 7jL79tJlMIK
InChI InChI=1S/C22H38O/c1-2-3-4-5-6-7-8-9-10-11-12-13-14-15-17-21-18-16-19-22(23)20-21/h16,18-20,23H,2-15,17H2,1H3
InChIKey GDVLCNQYYICCCQ-UHFFFAOYSA-N
Mol Weight 318.5 g/mol
Molecular Formula C22H38O
Exact Mass 318.292266 g/mol

Vapor Phase (Gas) Infrared Spectrum

Vapor Phase (Gas) Infrared Spectrum

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SpectraBase Spectrum ID En69itBVzVX
Name Phenol, 3-hexadecyl-
Comments Computed using SmartSpectra Model v1.42
Copyright Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 318.292265843 u
Formula C22H38O
InChI InChI=1S/C22H38O/c1-2-3-4-5-6-7-8-9-10-11-12-13-14-15-17-21-18-16-19-22(23)20-21/h16,18-20,23H,2-15,17H2,1H3
InChIKey GDVLCNQYYICCCQ-UHFFFAOYSA-N
Molecular Weight 318.545 g/mol
SMILES C1(=CC(=CC=C1)CCCCCCCCCCCCCCCC)O
Spectrum/Structure Validation Score (Vapor Phase IR) 0.915727