Dataset

Tributyl phosphate

This MassBank record with Accession MSBNK-Antwerp_Univ-AN118214 contains the MS2 mass spectrum of Tributyl phosphate with the InChIkey STCOOQWBFONSKY-UHFFFAOYSA-N.

Chemical Info

InChI	InChI=1S/C12H27O4P/c1-4-7-10-14-17(13,15-11-8-5-2)16-12-9-6-3/h4-12H2,1-3H3
SMILES	CCCCOP(=O)(OCCCC)OCCCC
InChI Key	STCOOQWBFONSKY-UHFFFAOYSA-N
Molecular Formula	C12H27O4P
Exact Mass	266.165 g/mol

Data and Resources

Tributyl phosphateHTML
Explore
- More information
- Go to resource

Metadata Information

Field	Value
DOI
License URL	https://creativecommons.org/licenses/by/4.0
Source	https://massbank.eu/MassBank/RecordDisplay?id=MSBNK-Antwerp_Univ-AN118214
Version
Author
Maintainer
Language
MetadataCreated	2024-01-11T09:38:35.007702
MetadataModified	2025-02-08T18:50:45.338997
MetadataPublished	2021-08-09

Field	Value
Measurement Technique	liquid chromatography-mass spectrometry
Measurement Variables

Data-Source Molecule ID	Data-Source
474524	eMolecules
95UAS8YAF5	FDA SRS
31357	PubChem
15221732	PubChem: Thomson Pharma
126-73-8	ACToR
SCHEMBL18570	SureChEMBL
20046304	NMRShiftDB
CB4187323	ChemicalBook
C14439	KEGG Ligand
CHEMBL1371096	ChEMBL
35019	ChEBI
ZINC000001586777	ZINC
CB12572456	ChemicalBook
DTXSID3021986	EPA CompTox Dashboard
MCULE-3436505303	Mcule
TRIBUTYL PHOSPHATE	rxnorm
231778	Brenda
HMDB0259164	Human Metabolome Database
CB0579993	ChemicalBook
J3.623D	Nikkaji
The data in this table is sourced from UniChem at EBI.