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4-(2,4,6-Trimethylbenzyl)phenol

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

4-(2,4,6-Trimethylbenzyl)phenol
SpectraBase Compound ID Egp9dZ8vz9I
InChI InChI=1S/C16H18O/c1-11-8-12(2)16(13(3)9-11)10-14-4-6-15(17)7-5-14/h4-9,17H,10H2,1-3H3
InChIKey NAUVFHJQRLGXRL-UHFFFAOYSA-N
Mol Weight 226.32 g/mol
Molecular Formula C16H18O
Exact Mass 226.135765 g/mol

Vapor Phase (Gas) Infrared Spectrum

Vapor Phase (Gas) Infrared Spectrum

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SpectraBase Spectrum ID Jc1XOG5x3Z0
Name 4-(2,4,6-Trimethylbenzyl)phenol
Comments Computed using SmartSpectra Model v1.42
Copyright Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 226.135765199 u
Formula C16H18O
InChI InChI=1S/C16H18O/c1-11-8-12(2)16(13(3)9-11)10-14-4-6-15(17)7-5-14/h4-9,17H,10H2,1-3H3
InChIKey NAUVFHJQRLGXRL-UHFFFAOYSA-N
Molecular Weight 226.319 g/mol
SMILES C1(=C(C=C(C=C1C)C)C)CC1=CC=C(C=C1)O
Spectrum/Structure Validation Score (Vapor Phase IR) 0.954328