SpectraBase Spectrum ID |
6lfiWICZQE6 |
Name |
4,4'-Sulfinylbis(5-tert-butyl-2-methylphenol) |
Comments |
Computed using SmartSpectra Model v1.42 |
Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
Exact Mass |
374.191565997 u |
Formula |
C22H30O3S |
InChI |
InChI=1S/C22H30O3S/c1-13-9-19(15(11-17(13)23)21(3,4)5)26(25)20-10-14(2)18(24)12-16(20)22(6,7)8/h9-12,23-24H,1-8H3 |
InChIKey |
KLRMOJPNFUOZJH-UHFFFAOYSA-N |
Molecular Weight |
374.539 g/mol |
SMILES |
CC(C1=CC(=C(C=C1S(C1=C(C=C(C(=C1)C)O)C(C)(C)C)=O)C)O)(C)C |
Spectrum/Structure Validation Score (Vapor Phase IR) |
0.962793 |