Dataset

Zapotinin

This MassBank record with Accession MSBNK-BS-BS003523 contains the MS mass spectrum of Zapotinin with the InChIkey BFXYIQRRGIMMSR-UHFFFAOYSA-N.

Chemical Info

molecular Image
InChI InChI=1S/C18H16O6/c1-21-11-5-4-6-12(22-2)17(11)15-9-10(19)16-13(24-15)7-8-14(23-3)18(16)20/h4-9,20H,1-3H3
SMILES C(OC1=C(C(=C(C(=C1[H])[H])[H])OC([H])([H])[H])C2=C(C(=O)C3=C(O2)C(=C(C(=C3O[H])OC([H])([H])[H])[H])[H])[H])([H])([H])[H]
InChI Key BFXYIQRRGIMMSR-UHFFFAOYSA-N
Molecular Formula C18H16O6
Exact Mass 328.095 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-BS-BS003523
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MetadataCreated 2024-01-11T12:38:41.223952
MetadataModified 2025-02-09T08:47:55.935987
MetadataPublished 2017-12-01
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