Dataset

1,6-Bis(acryloyloxy)hexane

This MassBank record with Accession MSBNK-Athens_Univ-AU503203 contains the MS2 mass spectrum of 1,6-Bis(acryloyloxy)hexane with the InChIkey FIHBHSQYSYVZQE-UHFFFAOYSA-N.

Chemical Info

molecular Image
InChI InChI=1S/C12H18O4/c1-3-11(13)15-9-7-5-6-8-10-16-12(14)4-2/h3-4H,1-2,5-10H2
SMILES C=CC(=O)OCCCCCCOC(=O)C=C
InChI Key FIHBHSQYSYVZQE-UHFFFAOYSA-N
Molecular Formula C12H18O4
Exact Mass 226.120 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-Athens_Univ-AU503203
Version
Author
Maintainer
Language
MetadataCreated 2024-01-11T09:50:11.718061
MetadataModified 2025-02-08T19:14:01.305997
MetadataPublished 2021-04-19
Field Value
Measurement Technique liquid chromatography-mass spectrometry
Measurement Variables
Data-Source Molecule ID Data-Source
CHEMBL1530684 ChEMBL
J82.105E Nikkaji
BEFNUY CCDC
ZINC000002019846 ZINC
DTXSID9025401 EPA CompTox Dashboard
15220563 PubChem: Thomson Pharma
FY751V5MMY FDA SRS
25644 PubChem
106717-06-0 ACToR
13048-33-4 ACToR
491510 eMolecules
CB1114704 ChemicalBook
SCHEMBL33725 SureChEMBL
The data in this table is sourced from UniChem at EBI.