| SpectraBase Spectrum ID |
LGECs8GMLzp |
| Name |
1,4,7,10,13-Pentaoxa-16-thiacyclooctadecane-3,14,17-trione |
| CAS Registry Number |
79687-38-0 |
| Copyright |
Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula |
C12H18O8S |
| InChI |
InChI=1S/C12H18O8S/c13-10-7-18-8-12(15)21-9-11(14)20-6-4-17-2-1-16-3-5-19-10/h1-9H2 |
| InChIKey |
NQVYWSHBYVOBJU-UHFFFAOYSA-N |
| Molecular Weight |
322.328 g/mol |
| SMILES |
C1(CSC(COCC(OCCOCCOCCO1)=O)=O)=O |
| SPLASH |
splash10-000i-9500000000-f92eb1aa07f938f65f35 |
| Source of Spectrum |
W5-1989-37134-28402 |
| Wiley ID |
1321272 |
