Dataset

Triethylphosphate

This MassBank record with Accession MSBNK-Antwerp_Univ-AN116903 contains the MS2 mass spectrum of Triethylphosphate with the InChIkey DQWPFSLDHJDLRL-UHFFFAOYSA-N.

Chemical Info

molecular Image
InChI InChI=1S/C6H15O4P/c1-4-8-11(7,9-5-2)10-6-3/h4-6H2,1-3H3
SMILES CCOP(=O)(OCC)OCC
InChI Key DQWPFSLDHJDLRL-UHFFFAOYSA-N
Molecular Formula C6H15O4P
Exact Mass 182.071 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-Antwerp_Univ-AN116903
Version
Author
Maintainer
Language
MetadataCreated 2024-01-11T09:36:07.332692
MetadataModified 2025-02-08T18:47:14.697072
MetadataPublished 2021-08-09
Field Value
Measurement Technique liquid chromatography-mass spectrometry
Measurement Variables
Data-Source Molecule ID Data-Source
CHEMBL1236251 ChEMBL
45927 ChEBI
DB03347 DrugBank
TEN PDBe
BTFZEP CCDC
DTXSID8026228 EPA CompTox Dashboard
CB62572628 ChemicalBook
HMDB0259191 Human Metabolome Database
CB02569637 ChemicalBook
ZINC000001641077 ZINC
J2.406F Nikkaji
14843256 PubChem: Thomson Pharma
6535 PubChem
78-40-0 ACToR
PD007064 ProbesDrugs
QIH4K96K7J FDA SRS
518767 eMolecules
CB1854370 ChemicalBook
10016985 NMRShiftDB
SCHEMBL21887 SureChEMBL
The data in this table is sourced from UniChem at EBI.