Dataset

4-hydroxy-2,5,5,9-tetramethylcycloundeca-2,9-dienyl 4-hydroxybenzoate

This MassBank record with Accession MSBNK-Washington_State_Univ-BML80410 contains the MS mass spectrum of 4-hydroxy-2,5,5,9-tetramethylcycloundeca-2,9-dienyl 4-hydroxybenzoate with the InChIkey JDZBITULCWBIMC-UHFFFAOYSA-N.

Chemical Info

molecular Image
InChI InChI=1S/C22H30O4/c1-15-6-5-13-22(3,4)20(24)14-16(2)19(12-7-15)26-21(25)17-8-10-18(23)11-9-17/h7-11,14,19-20,23-24H,5-6,12-13H2,1-4H3
SMILES CC1=CCC(C(=CC(C(CCC1)(C)C)O)C)OC(=O)C2=CC=C(C=C2)O
InChI Key JDZBITULCWBIMC-UHFFFAOYSA-N
Molecular Formula C22H30O4
Exact Mass 358.214 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-Washington_State_Univ-BML80410
Version
Author
Maintainer
Language
MetadataCreated 2024-01-11T22:28:35.188733
MetadataModified 2024-01-11T22:28:35.356305
MetadataPublished 2016-01-19
Field Value
Measurement Technique liquid chromatography-mass spectrometry
Measurement Variables
Data-Source Molecule ID Data-Source
3327183 PubChem
The data in this table is sourced from UniChem at EBI.