Dataset

Liquiritin

This MassBank record with Accession MSBNK-RIKEN-PR310484 contains the MS2 mass spectrum of Liquiritin with the InChIkey DEMKZLAVQYISIA-UHFFFAOYSA-N.

Chemical Info

molecular Image
InChI InChI=1S/C21H22O9/c22-9-17-18(25)19(26)20(27)21(30-17)28-12-4-1-10(2-5-12)15-8-14(24)13-6-3-11(23)7-16(13)29-15/h1-7,15,17-23,25-27H,8-9H2
SMILES O=C3C=4C=CC(O)=CC=4(OC(C2=CC=C(OC1OC(CO)C(O)C(O)C1(O))C=C2)C3)
InChI Key DEMKZLAVQYISIA-UHFFFAOYSA-N
Molecular Formula C21H22O9
Exact Mass 418.398 g/mol

Data and Resources

Metadata Information

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DOI
License URL https://creativecommons.org/licenses/by-nc-sa/4.0
Source https://massbank.eu/MassBank/RecordDisplay?id=MSBNK-RIKEN-PR310484
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MetadataCreated 2024-01-11T19:46:19.692159
MetadataModified 2025-02-09T18:33:44.932522
MetadataPublished 2019-03-28
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