Dataset

Dehydro-piliformic-acid

This MassBank record with Accession MSBNK-Fiocruz-FIO00852 contains the MS2 mass spectrum of Dehydro-piliformic-acid with the InChIkey XXJJXRVXYCYMBK-INTFFVIUSA-N.

Chemical Info

molecular Image
InChI InChI=1S/C11H16O4/c1-3-4-5-6-7-9(11(14)15)8(2)10(12)13/h3,7-8H,1,4-6H2,2H3,(H,12,13)(H,14,15)/b9-7+/t8-/m0/s1
SMILES C=CCCCC=C(C(O)=O)C(C)C(O)=O
InChI Key XXJJXRVXYCYMBK-INTFFVIUSA-N
Molecular Formula C11H16O4
Exact Mass 212.105 g/mol

Data and Resources

Metadata Information

Field Value
DOI
License URL https://creativecommons.org/licenses/by/4.0
Source https://massbank.eu/MassBank/RecordDisplay?id=MSBNK-Fiocruz-FIO00852
Version
Author
Maintainer
Language
MetadataCreated 2024-01-11T16:35:05.932289
MetadataModified 2025-02-09T13:04:23.153395
MetadataPublished 2019-01-14
Field Value
Measurement Technique liquid chromatography-mass spectrometry
Measurement Variables
Data-Source Molecule ID Data-Source
137628584 PubChem
The data in this table is sourced from UniChem at EBI.