SpectraBase Spectrum ID |
4xM3XSrvAVq |
Name |
Phenol, 4,4'-[thiobis(methylene)]bis[2,6-bis(1,1-dimethylethyl)- |
Comments |
Computed using SmartSpectra Model v1.42 |
Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
Exact Mass |
470.321851893 u |
Formula |
C30H46O2S |
InChI |
InChI=1S/C30H46O2S/c1-27(2,3)21-13-19(14-22(25(21)31)28(4,5)6)17-33-18-20-15-23(29(7,8)9)26(32)24(16-20)30(10,11)12/h13-16,31-32H,17-18H2,1-12H3 |
InChIKey |
UDFARPRXWMDFQU-UHFFFAOYSA-N |
Molecular Weight |
470.756 g/mol |
SMILES |
CC(C)(C)C1=C(O)C(C(C)(C)C)=CC(=C1)CSCC1=CC(C(C)(C)C)=C(C(C(C)(C)C)=C1)O |
Spectrum/Structure Validation Score (Vapor Phase IR) |
0.979294 |