Dataset

Triethylphosphate

This MassBank record with Accession MSBNK-Antwerp_Univ-AN116902 contains the MS2 mass spectrum of Triethylphosphate with the InChIkey DQWPFSLDHJDLRL-UHFFFAOYSA-N.

Chemical Info

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

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Metadata Information

Field	Value
DOI
License URL
Source	https://massbank.eu/MassBank/RecordDisplay?id=MSBNK-Antwerp_Univ-AN116902
Version
Author
Maintainer
Language
MetadataCreated	2024-01-11T09:30:06.566537
MetadataModified	2024-01-11T09:30:06.844414
MetadataPublished	2021-08-09

Field	Value
Measurement Technique	liquid chromatography-mass spectrometry
Measurement Variables

Data-Source Molecule ID	Data-Source
TEN	PDBe
DB03347	DrugBank
45927	ChEBI
CHEMBL1236251	ChEMBL
518767	eMolecules
ZINC000001641077	ZINC
DTXSID8026228	EPA CompTox Dashboard
CB1854370	ChemicalBook
QIH4K96K7J	FDA SRS
6535	PubChem
78-40-0	ACToR
14843256	PubChem: Thomson Pharma
PD007064	ProbesDrugs
SCHEMBL21887	SureChEMBL
10016985	NMRShiftDB
HMDB0259191	Human Metabolome Database
BTFZEP	CCDC
CB62572628	ChemicalBook
CB02569637	ChemicalBook
J2.406F	Nikkaji
The data in this table is sourced from UniChem at EBI.