SpectraBase Spectrum ID |
9NriNskpyo |
Name |
Phenol, 2-(1,1-dimethylethyl)-6-[[[[3-(1,1-dimethylethyl)-2-hydroxy-5-methylphenyl]methyl](2-methylpropyl)amino]methyl]-4-methyl- |
Comments |
Computed using SmartSpectra Model v1.42 |
Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
Exact Mass |
425.329379627 u |
Formula |
C28H43NO2 |
InChI |
InChI=1S/C28H43NO2/c1-18(2)15-29(16-21-11-19(3)13-23(25(21)30)27(5,6)7)17-22-12-20(4)14-24(26(22)31)28(8,9)10/h11-14,18,30-31H,15-17H2,1-10H3 |
InChIKey |
ZIQGZFCJRDPDKZ-UHFFFAOYSA-N |
Molecular Weight |
425.657 g/mol |
SMILES |
C1(=C(C(C(C)(C)C)=CC(=C1)C)O)CN(CC=1C(=C(C(C)(C)C)C=C(C1)C)O)CC(C)C |
Spectrum/Structure Validation Score (Vapor Phase IR) |
0.836265 |