Dataset

BUTYL GLYOXYLATE DIBUTYLACETAL

This MassBank record with Accession MSBNK-Fac_Eng_Univ_Tokyo-JP008280 contains the MS mass spectrum of BUTYL GLYOXYLATE DIBUTYLACETAL with the InChIkey LEQXXBBCRATLPW-UHFFFAOYSA-N.

Chemical Info

molecular Image
InChI InChI=1S/C14H28O4/c1-4-7-10-16-13(15)14(17-11-8-5-2)18-12-9-6-3/h14H,4-12H2,1-3H3
SMILES CCCCOC(=O)C(OCCCC)OCCCC
InChI Key LEQXXBBCRATLPW-UHFFFAOYSA-N
Molecular Formula C14H28O4
Exact Mass 260.199 g/mol

Data and Resources

Metadata Information

Field Value
DOI
License URL https://creativecommons.org/licenses/by-nc-sa/4.0
Source https://massbank.eu/MassBank/RecordDisplay?id=MSBNK-Fac_Eng_Univ_Tokyo-JP008280
Version
Author
Maintainer
Language
MetadataCreated 2024-01-11T15:55:52.843195
MetadataModified 2024-01-11T15:55:53.015671
MetadataPublished 2016-01-19
Field Value
Measurement Technique liquid chromatography-mass spectrometry
Measurement Variables
Data-Source Molecule ID Data-Source
545227 PubChem
DTXSID50337873 EPA CompTox Dashboard
J47.639K Nikkaji
SCHEMBL3720214 SureChEMBL
The data in this table is sourced from UniChem at EBI.