Dataset

31P nuclear magnetic resonance spectroscopy (31P NMR)

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

Chemical Information

molecular Image
InChI InChI=1S/C11H17O3P/c1-8-6-9(2)11(10(3)7-8)15(12,13-4)14-5/h6-7H,1-5H3
SMILES COP(=O)(c1c(C)cc(cc1C)C)OC
InChI Key SJCMNWBMJLIBAW-UHFFFAOYSA-N
Molecular Formula C11H17O3P
Exact Mass 228.225 g/mol

Data and Resources

Metadata Information

Field Value
DOI 10.14272/SJCMNWBMJLIBAW-UHFFFAOYSA-N/CHMO0000739
License URL
Source https://www.chemotion-repository.net/inchikey/SJCMNWBMJLIBAW-UHFFFAOYSA-N/CHMO0000739
Version
Author Christoph Zippel
Maintainer Chemotion Repository
Language english
MetadataPublished 2022-01-10
Related Molecule
  • 2-dimethoxyphosphoryl-1,3,5-trimethylbenzene
    • Field Value
    Measurement Technique 31P nuclear magnetic resonance spectroscopy
    Measurement Variables
    Data-Source Molecule ID Data-Source
    13836137 PubChem
    J3.252.773F Nikkaji
    ZINC000034164997 ZINC
    SCHEMBL10726879 SureChEMBL
    The data in this table is sourced from UniChem at EBI.