Pinocembrine
URL: https://massbank.eu/MassBank/RecordDisplay?id=MSBNK-Washington_State_Univ-BML00129
Dataset description:
This MassBank record with Accession MSBNK-Washington_State_Univ-BML00129 contains the MS2 mass spectrum of Pinocembrine with the InChIkey URFCJEUYXNAHFI-CYBMUJFWSA-N.
Source: Pinocembrine
Chemical Info
| InChI | InChI=1S/C15H12O4/c16-10-6-11(17)15-12(18)8-13(19-14(15)7-10)9-4-2-1-3-5-9/h1-7,13,16-17H,8H2/t13-/m1/s1 |
|---|---|
| SMILES | C1[C@@H](OC2=CC(=CC(=C2C1=O)O)O)C3=CC=CC=C3 |
| InChI Key | URFCJEUYXNAHFI-CYBMUJFWSA-N |
| Molecular Formula | C15H12O4 |
| Exact Mass | 256.074 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 | a27ca1d1-96a5-45ce-bcf9-af41e0796e73 |
| Package id | msbnk-washington_state_univ-bml00129 |
| Resource type | HTML |
| State | active |