Dataset

electron ionisation mass spectrometry (EI-MS)

dataset for electron ionisation mass spectrometry (EI-MS)

Chemical Information

molecular Image
InChI InChI=1S/C10H13O5P/c1-13-10(11)8-4-6-9(7-5-8)16(12,14-2)15-3/h4-7H,1-3H3
SMILES COC(=O)c1ccc(cc1)P(=O)(OC)OC
InChI Key QJGWDEWFFPKFQG-UHFFFAOYSA-N
Molecular Formula C10H13O5P
Exact Mass 244.181 g/mol

Data and Resources

Metadata Information

Field Value
DOI 10.14272/QJGWDEWFFPKFQG-UHFFFAOYSA-N/CHMO0000480
License URL
Source https://www.chemotion-repository.net/inchikey/QJGWDEWFFPKFQG-UHFFFAOYSA-N/CHMO0000480
Version
Author Christoph Zippel
Maintainer Chemotion Repository
Language english
MetadataPublished 2022-01-10
Related Molecule
  • methyl 4-dimethoxyphosphorylbenzoate
    • Field Value
    Measurement Technique electron ionisation mass spectrometry
    Measurement Variables
    Data-Source Molecule ID Data-Source
    SCHEMBL11581923 SureChEMBL
    23415639 PubChem
    J3.505.908C Nikkaji
    The data in this table is sourced from UniChem at EBI.