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

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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

Bis(1,3-dichloro-2-propyl) phosphateHTML
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Metadata Information

Field	Value
DOI
License URL
Source	https://massbank.eu/MassBank/RecordDisplay?id=MSBNK-Antwerp_Univ-AN119702
Version
Author
Maintainer
Language
MetadataCreated	2024-01-11T09:29:22.401795
MetadataModified	2024-01-11T09:29:22.566174
MetadataPublished	2021-08-11

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.