Dataset

Bis(1,3-dichloro-2-propyl) phosphate

This MassBank record with Accession MSBNK-Antwerp_Univ-AN119702 contains the MS2 mass spectrum of Bis(1,3-dichloro-2-propyl) phosphate with the InChIkey NNKRUBFJSSBFSS-UHFFFAOYSA-N.

Chemical Info

molecular Image
InChI InChI=1S/C6H11Cl4O4P/c7-1-5(2-8)13-15(11,12)14-6(3-9)4-10/h5-6H,1-4H2,(H,11,12)
SMILES C(C(CCl)OP(=O)(O)OC(CCl)CCl)Cl
InChI Key NNKRUBFJSSBFSS-UHFFFAOYSA-N
Molecular Formula C6H11Cl4O4P
Exact Mass 317.915 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-AN119702
Version
Author
Maintainer
Language
MetadataCreated 2024-01-11T09:29:22.401795
MetadataModified 2025-02-08T18:49:19.378926
MetadataPublished 2021-08-11
Related Molecule
Field Value
Measurement Technique liquid chromatography-mass spectrometry
Measurement Variables
Data-Source Molecule ID Data-Source
72236-72-7 ACToR
188119 PubChem
J521.188C Nikkaji
SCHEMBL2780658 SureChEMBL
166469 ChEBI
The data in this table is sourced from UniChem at EBI.