Allicin (not validated)
URL: https://massbank.eu/MassBank/RecordDisplay?id=MSBNK-RIKEN-PR311159
Dataset description:
This MassBank record with Accession MSBNK-RIKEN-PR311159 contains the MS2 mass spectrum of Allicin (not validated) with the InChIkey JDLKFOPOAOFWQN-UHFFFAOYSA-N.
Source: Allicin (not validated)
Chemical Info
| InChI | InChI=1S/C6H10OS2/c1-3-5-8-9(7)6-4-2/h3-4H,1-2,5-6H2 |
|---|---|
| SMILES | O=S(CC=C)SCC=C |
| InChI Key | JDLKFOPOAOFWQN-UHFFFAOYSA-N |
| Molecular Formula | C6H10OS2 |
| Exact Mass | 162.275 g/mol |
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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 | e575ce3e-b57e-43ec-98e7-6a2b208dae57 |
| Package id | msbnk-riken-pr311159 |
| Resource type | HTML |
| State | active |