| SpectraBase Spectrum ID |
3pwHrnCmYwn |
| Name |
Methyl 13,14-bis(methylthio)-2-hydroxydocosanoate |
| Alternate Name(s) |
Methyl 2-hydroxy-13,14-bis(methylsulfanyl)docosanoate |
| Copyright |
Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula |
C25H50O3S2 |
| InChI |
InChI=1S/C25H50O3S2/c1-5-6-7-8-14-17-20-23(29-3)24(30-4)21-18-15-12-10-9-11-13-16-19-22(26)25(27)28-2/h22-24,26H,5-21H2,1-4H3 |
| InChIKey |
XXHLWVZTDUADRR-UHFFFAOYSA-N |
| Molecular Weight |
462.792 g/mol |
| SMILES |
OC(C(=O)OC)CCCCCCCCCCC(C(CCCCCCCC)SC)SC |
| SPLASH |
splash10-00g4-5691100000-683c39df72ca4d2ed54d |
| Source of Spectrum |
X2-57-618-0 |
| Wiley ID |
1605412 |
