For citations & permissions, please see: Citations & Permissions - Wiley Science Solutions*

*Links on SpectraBase are not permalinks.

Phenol, 3-benzyloxy-2-[3-oxo-hexadecyl]-

View entire compound with spectra: 1 NMR

Phenol, 3-benzyloxy-2-[3-oxo-hexadecyl]-
SpectraBase Compound ID DO5XIWZpZTz
InChI InChI=1S/C29H40O4/c1-2-3-4-5-6-7-8-9-10-11-15-19-25(30)22-27(32)29-26(31)20-16-21-28(29)33-23-24-17-13-12-14-18-24/h12-14,16-18,20-21,31H,2-11,15,19,22-23H2,1H3
InChIKey HJCZNPIPKYVNAV-UHFFFAOYSA-N
Mol Weight 452.6 g/mol
Molecular Formula C29H40O4
Exact Mass 452.29266 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

View the Full Spectrum for FREE!

The full spectrum can only be viewed using a FREE account.

SpectraBase Spectrum ID FWhKVBtfEVA
Name Phenol, 3-benzyloxy-2-[3-oxo-hexadecyl]-
Comments Computed using HOSE algorithm
Copyright Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 452.292659764 u
Formula C29H40O4
InChI InChI=1S/C29H40O4/c1-2-3-4-5-6-7-8-9-10-11-15-19-25(30)22-27(32)29-26(31)20-16-21-28(29)33-23-24-17-13-12-14-18-24/h12-14,16-18,20-21,31H,2-11,15,19,22-23H2,1H3
InChIKey HJCZNPIPKYVNAV-UHFFFAOYSA-N
Molecular Weight 452.635 g/mol
SMILES C1(=C(C(=CC=C1)OCC1=CC=CC=C1)C(CC(CCCCCCCCCCCCC)=O)=O)O