| SpectraBase Spectrum ID |
2ocQygZpOU4 |
| Name |
Probucol |
| CAS Registry Number |
23288-49-5 |
| Classification |
Pharmaceutical drug, anti-hyperlipidemic |
| Copyright |
Copyright © 2024 DigiLab GmbH and Wiley-VCH GmbH. All Rights Reserved. |
| Exact Mass |
516.309573132 u |
| Formula |
C31H48O2S2 |
| InChI |
InChI=1S/C31H48O2S2/c1-27(2,3)21-15-19(16-22(25(21)32)28(4,5)6)34-31(13,14)35-20-17-23(29(7,8)9)26(33)24(18-20)30(10,11)12/h15-18,32-33H,1-14H3 |
| InChIKey |
FYPMFJGVHOHGLL-UHFFFAOYSA-N |
| Ionization Type |
Electron Ionization (EI) |
| Molecular Weight |
516.843 g/mol |
| Nominal Mass |
516 u |
| Quality |
991 |
| Retention Index |
3665 |
| SMILES |
OC=1C(=CC(SC(SC=2C=C(C(=C(C2)C(C)(C)C)O)C(C)(C)C)(C)C)=CC1C(C)(C)C)C(C)(C)C |
| SPLASH |
splash10-004i-2490000000-5bf61aa9c8b6fad8af96 |
| Source of Spectrum |
DigiLab GmbH (C) 2024 |
| Synonyms |
4,4'-(Isopropylidenedithio)bis[2,6-di-tert-butylphenol]
2,6-Ditert-butyl-4-[1-(3,5-ditert-butyl-4-hydroxy-phenyl)sulfanyl-1-methyl-ethyl]sulfanyl-phenol |
| Technique |
GC/MS |
| Wiley ID |
DD2024_011999 |
