Dataset

electron ionisation mass spectrometry (EI-MS)

dataset for electron ionisation mass spectrometry (EI-MS)\n\n

Chemical Info

molecular Image
InChI InChI=1S/C10H11O3PS/c1-12-14(11,13-2)9-3-4-10-8(7-9)5-6-15-10/h3-7H,1-2H3
SMILES COP(=O)(c1ccc2c(c1)ccs2)OC
InChI Key VLRAYJRKPYKDDY-UHFFFAOYSA-N
Molecular Formula C10H11O3PS
Exact Mass 242.231 g/mol

Data and Resources

Metadata Information

Field Value
DOI 10.14272/VLRAYJRKPYKDDY-UHFFFAOYSA-N/CHMO0000480
License URL
Source https://www.chemotion-repository.net/inchikey/VLRAYJRKPYKDDY-UHFFFAOYSA-N/CHMO0000480
Version
Author Christoph Zippel
Maintainer Chemotion Repository
Language english
MetadataCreated 2024-09-07T05:46:25.748578
MetadataModified 2024-09-07T21:21:02.700590
MetadataPublished 2022-01-21
Field Value
Measurement Technique electron ionisation mass spectrometry
Measurement Variables
Data-Source Molecule ID Data-Source
162396636 PubChem
The data in this table is sourced from UniChem at EBI.