Psoralen
URL: https://massbank.eu/MassBank/RecordDisplay?id=MSBNK-Washington_State_Univ-BML00655
Dataset description:
This MassBank record with Accession MSBNK-Washington_State_Univ-BML00655 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 | 9526dc7b-fd2c-47f8-afce-933f61026d5c |
Package id | msbnk-washington_state_univ-bml00655 |
Resource type | HTML |
State | active |