(Methylsulfinyl)octyl glucosinolate
URL: https://massbank.eu/MassBank/RecordDisplay?id=MSBNK-RIKEN-PR309212
Dataset description:
This MassBank record with Accession MSBNK-RIKEN-PR309212 contains the MS2 mass spectrum of (Methylsulfinyl)octyl glucosinolate with the InChIkey GPMDJOOLATZDQL-UHFFFAOYSA-N.
Chemical Info
| InChI | InChI=1S/C16H31NO10S3/c1-29(22)9-7-5-3-2-4-6-8-12(17-27-30(23,24)25)28-16-15(21)14(20)13(19)11(10-18)26-16/h11,13-16,18-21H,2-10H2,1H3,(H,23,24,25) |
|---|---|
| SMILES | O=S(C)CCCCCCCCC(=NOS(=O)(=O)O)SC1OC(CO)C(O)C(O)C1(O) |
| InChI Key | GPMDJOOLATZDQL-UHFFFAOYSA-N |
| Molecular Formula | C16H31NO10S3 |
| Exact Mass | 493.616 g/mol |
There are no views created for this resource yet.
Additional Information
| Field | Value |
|---|---|
| Data last updated | January 11, 2024 |
| Metadata last updated | January 11, 2024 |
| Created | January 11, 2024 |
| Format | HTML |
| License | Attribution-NonCommercial-ShareAlike 4.0 International (CC BY-NC-SA 4.0) |
| Id | ca2bf1cb-ba68-4f15-8693-7680943ffe46 |
| Package id | msbnk-riken-pr309212 |
| Resource type | HTML |
| State | active |