Dataset

Triphenyl phosphate

This MassBank record with Accession MSBNK-Antwerp_Univ-AN118302 contains the MS2 mass spectrum of Triphenyl phosphate with the InChIkey XZZNDPSIHUTMOC-UHFFFAOYSA-N.

Chemical Info

molecular Image
InChI InChI=1S/C18H15O4P/c19-23(20-16-10-4-1-5-11-16,21-17-12-6-2-7-13-17)22-18-14-8-3-9-15-18/h1-15H
SMILES C1=CC=C(C=C1)OP(=O)(OC2=CC=CC=C2)OC3=CC=CC=C3
InChI Key XZZNDPSIHUTMOC-UHFFFAOYSA-N
Molecular Formula C18H15O4P
Exact Mass 326.071 g/mol

Data and Resources

Metadata Information

Field Value
DOI
License URL
Source https://massbank.eu/MassBank/RecordDisplay?id=MSBNK-Antwerp_Univ-AN118302
Version
Author
Maintainer
Language
MetadataCreated 2024-01-11T09:31:03.810122
MetadataModified 2024-01-11T09:31:04.037842
MetadataPublished 2021-08-09
Field Value
Measurement Technique liquid chromatography-mass spectrometry
Measurement Variables
Data-Source Molecule ID Data-Source
C14235 KEGG Ligand
CHEMBL454511 ChEMBL
35033 ChEBI
478025 eMolecules
DTXSID1021952 EPA CompTox Dashboard
ZINC000001688738 ZINC
103700 Brenda
CB9233809 ChemicalBook
MCULE-9737362370 Mcule
HMDB0259262 Human Metabolome Database
TPHEPO CCDC
J2.469D Nikkaji
8289 PubChem
YZE19Z66EA FDA SRS
14752955 PubChem: Thomson Pharma
115-86-6 ACToR
SCHEMBL18116 SureChEMBL
The data in this table is sourced from UniChem at EBI.