SpectraBase Spectrum ID |
KtXzeAW7JcQ |
Name |
Phenol, 2-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/c1-2-3-4-5-6-7-8-9-10-11-12-13-14-15-18-21-19-16-17-20-22(21)23/h16-17,19-20,23H,2-15,18H2,1H3 |
InChIKey |
HMWIHOZPGQRZLR-UHFFFAOYSA-N |
Molecular Weight |
318.545 g/mol |
SMILES |
CCCCCCCCCCCCCCCCC1=CC=CC=C1O |
Spectrum/Structure Validation Score (Vapor Phase IR) |
0.922666 |