Dataset

Griseofulvin

This MassBank record with Accession MSBNK-AAFC-AC000512 contains the MS2 mass spectrum of Griseofulvin with the InChIkey DDUHZTYCFQRHIY-RBHXEPJQSA-N.

Chemical Info

molecular Image
InChI InChI=1S/C17H17ClO6/c1-8-5-9(19)6-12(23-4)17(8)16(20)13-10(21-2)7-11(22-3)14(18)15(13)24-17/h6-8H,5H2,1-4H3/t8-,17+/m1/s1
SMILES C[C@@H]1CC(=O)C=C([C@]12C(=O)C3=C(O2)C(=C(C=C3OC)OC)Cl)OC
InChI Key DDUHZTYCFQRHIY-RBHXEPJQSA-N
Molecular Formula C17H17ClO6
Exact Mass 352.071 g/mol

Data and Resources

Metadata Information

Field Value
DOI
License URL https://creativecommons.org/licenses/by-sa/4.0
Source https://massbank.eu/MassBank/RecordDisplay?id=MSBNK-AAFC-AC000512
Version
Author
Maintainer
Language
MetadataCreated 2024-01-11T09:21:32.998683
MetadataModified 2024-01-11T09:21:33.154258
MetadataPublished 2017-07-07
Field Value
Measurement Technique liquid chromatography-mass spectrometry
Measurement Variables