Psoralen
URL: https://massbank.eu/MassBank/RecordDisplay?id=MSBNK-Washington_State_Univ-BML00644
Dataset description:
This MassBank record with Accession MSBNK-Washington_State_Univ-BML00644 contains the MS2 mass spectrum of Psoralen with the InChIkey ZCCUUQDIBDJBTK-UHFFFAOYSA-N.
Source: Psoralen
Chemical Info
| InChI | InChI=1S/C11H6O3/c12-11-2-1-7-5-8-3-4-13-9(8)6-10(7)14-11/h1-6H |
|---|---|
| SMILES | C1=CC(=O)OC2=CC3=C(C=CO3)C=C21 |
| InChI Key | ZCCUUQDIBDJBTK-UHFFFAOYSA-N |
| Molecular Formula | C11H6O3 |
| Exact Mass | 186.032 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 | 498faa91-f1b6-47e4-ab26-eb4d8f801082 |
| Package id | msbnk-washington_state_univ-bml00644 |
| Resource type | HTML |
| State | active |