Dataset

31P nuclear magnetic resonance spectroscopy (31P NMR)

dataset for 31P nuclear magnetic resonance spectroscopy (31P NMR)

Chemical Information

molecular Image
InChI InChI=1S/C8H10ClO3P/c1-11-13(10,12-2)8-5-3-7(9)4-6-8/h3-6H,1-2H3
SMILES COP(=O)(c1ccc(cc1)Cl)OC
InChI Key UTGYZBPCVJGRBV-UHFFFAOYSA-N
Molecular Formula C8H10ClO3P
Exact Mass 220.590 g/mol

Data and Resources

Metadata Information

Field Value
DOI 10.14272/UTGYZBPCVJGRBV-UHFFFAOYSA-N/CHMO0000739
License URL
Source https://www.chemotion-repository.net/inchikey/UTGYZBPCVJGRBV-UHFFFAOYSA-N/CHMO0000739
Version
Author Christoph Zippel
Maintainer Chemotion Repository
Language english
MetadataPublished 2022-01-10
Related Molecule
  • 1-chloro-4-dimethoxyphosphorylbenzene
    • Field Value
    Measurement Technique 31P nuclear magnetic resonance spectroscopy
    Measurement Variables
    Data-Source Molecule ID Data-Source
    DTXSID00462664 EPA CompTox Dashboard
    ZINC000034485189 ZINC
    J1.901.743E Nikkaji
    11333508 PubChem
    SCHEMBL11804299 SureChEMBL
    16423920 PubChem: Thomson Pharma
    The data in this table is sourced from UniChem at EBI.