Daphnoretine Acetate
URL: https://massbank.eu/MassBank/RecordDisplay?id=MSBNK-Washington_State_Univ-BML01200
Dataset description:
This MassBank record with Accession MSBNK-Washington_State_Univ-BML01200 contains the MS2 mass spectrum of Daphnoretine Acetate with the InChIkey JGZOXTSCOZGQNQ-UHFFFAOYSA-N.
Source: Daphnoretine Acetate
Chemical Info
InChI | InChI=1S/C21H14O8/c1-11(22)26-18-10-16-13(7-17(18)25-2)8-19(21(24)29-16)27-14-5-3-12-4-6-20(23)28-15(12)9-14/h3-10H,1-2H3 |
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SMILES | CC(=O)OC1=C(C=C2C=C(C(=O)OC2=C1)OC3=CC4=C(C=C3)C=CC(=O)O4)OC |
InChI Key | JGZOXTSCOZGQNQ-UHFFFAOYSA-N |
Molecular Formula | C21H14O8 |
Exact Mass | 394.069 g/mol |
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Additional Information
Field | Value |
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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 | 62507ffb-5669-44cd-9477-febe7234a56d |
Package id | msbnk-washington_state_univ-bml01200 |
Resource type | HTML |
State | active |