Dataset

Flavonol base + 4O, 1MeO, O-Hex

This MassBank record with Accession MSBNK-RIKEN-PR310911 contains the MS2 mass spectrum of Flavonol base + 4O, 1MeO, O-Hex with the InChIkey AFCDXKGLUDDXCK-UHFFFAOYSA-N.

Chemical Info

molecular Image
InChI InChI=1S/C22H22O13/c1-32-21-11(34-22-19(31)17(29)14(26)12(6-23)35-22)5-10-13(16(21)28)15(27)18(30)20(33-10)7-2-3-8(24)9(25)4-7/h2-5,12,14,17,19,22-26,28-31H,6H2,1H3
SMILES O=C2C(O)=C(OC=3C=C(OC1OC(CO)C(O)C(O)C1(O))C(OC)=C(O)C2=3)C4=CC=C(O)C(O)=C4
InChI Key AFCDXKGLUDDXCK-UHFFFAOYSA-N
Molecular Formula C22H22O13
Exact Mass 494.405 g/mol

Data and Resources

Metadata Information

Field Value
DOI
License URL https://creativecommons.org/licenses/by-nc-sa/4.0
Source https://massbank.eu/MassBank/RecordDisplay?id=MSBNK-RIKEN-PR310911
Version
Author
Maintainer
Language
MetadataCreated 2024-01-11T19:50:37.784346
MetadataModified 2025-02-09T18:30:32.510331
MetadataPublished 2019-03-28
Related Molecule
Field Value
Measurement Technique liquid chromatography-mass spectrometry
Measurement Variables
Data-Source Molecule ID Data-Source
No additional information available for this Dataset.