Picrotin
URL: https://massbank.eu/MassBank/RecordDisplay?id=MSBNK-Washington_State_Univ-BML81947
Dataset description:
This MassBank record with Accession MSBNK-Washington_State_Univ-BML81947 contains the MS mass spectrum of Picrotin with the InChIkey RYEFFICCPKWYML-UHFFFAOYSA-N.
Source: Picrotin
Chemical Info
| InChI | InChI=1S/C15H18O7/c1-12(2,18)6-7-10(16)20-8(6)9-13(3)14(7,19)4-5-15(13,22-5)11(17)21-9/h5-9,18-19H,4H2,1-3H3 |
|---|---|
| SMILES | CC12C3C4C(C(C1(CC5C2(O5)C(=O)O3)O)C(=O)O4)C(C)(C)O |
| InChI Key | RYEFFICCPKWYML-UHFFFAOYSA-N |
| Molecular Formula | C15H18O7 |
| Exact Mass | 310.105 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-ShareAlike 4.0 International (CC BY-SA 4.0) |
| Id | 97eede04-e384-43bd-8f7f-3b24aae6c639 |
| Package id | msbnk-washington_state_univ-bml81947 |
| Resource type | HTML |
| State | active |