Dataset

Resorcinol bis(diphenyl phosphate)

This MassBank record with Accession MSBNK-Antwerp_Univ-AN118608 contains the MS2 mass spectrum of Resorcinol bis(diphenyl phosphate) with the InChIkey OWICEWMBIBPFAH-UHFFFAOYSA-N.

Chemical Info

molecular Image
InChI InChI=1S/C30H24O8P2/c31-39(33-25-14-5-1-6-15-25,34-26-16-7-2-8-17-26)37-29-22-13-23-30(24-29)38-40(32,35-27-18-9-3-10-19-27)36-28-20-11-4-12-21-28/h1-24H
SMILES C1=CC=C(C=C1)OP(=O)(OC2=CC=CC=C2)OC3=CC(=CC=C3)OP(=O)(OC4=CC=CC=C4)OC5=CC=CC=C5
InChI Key OWICEWMBIBPFAH-UHFFFAOYSA-N
Molecular Formula C30H24O8P2
Exact Mass 574.095 g/mol

Data and Resources

Metadata Information

Field Value
DOI
License URL
Source https://massbank.eu/MassBank/RecordDisplay?id=MSBNK-Antwerp_Univ-AN118608
Version
Author
Maintainer
Language
MetadataCreated 2024-01-11T09:31:53.150457
MetadataModified 2024-01-11T09:31:53.337653
MetadataPublished 2021-09-04
Field Value
Measurement Technique liquid chromatography-mass spectrometry
Measurement Variables
Data-Source Molecule ID Data-Source
J42.300I Nikkaji
93311 PubChem
16091203 PubChem: Thomson Pharma
156929-96-3 ACToR
57583-54-7 ACToR
SCHEMBL78015 SureChEMBL
ZINC000095704269 ZINC
DTXSID8069197 EPA CompTox Dashboard
CB8855422 ChemicalBook
The data in this table is sourced from UniChem at EBI.