Dataset

Ethephon

This MassBank record with Accession MSBNK-Eawag-EQ00348256 contains the MS2 mass spectrum of Ethephon with the InChIkey UDPGUMQDCGORJQ-UHFFFAOYSA-N.

Chemical Info

molecular Image
InChI InChI=1S/C2H6ClO3P/c3-1-2-7(4,5)6/h1-2H2,(H2,4,5,6)
SMILES C(CCl)P(=O)(O)O
InChI Key UDPGUMQDCGORJQ-UHFFFAOYSA-N
Molecular Formula C2H6ClO3P
Exact Mass 143.974 g/mol

Data and Resources

Metadata Information

Field Value
DOI
License URL https://creativecommons.org/licenses/by-sa/4.0
Source https://massbank.eu/MassBank/RecordDisplay?id=MSBNK-Eawag-EQ00348256
Version
Author
Maintainer
Language
MetadataCreated 2025-02-09T09:59:07.056131
MetadataModified 2025-02-09T09:59:07.233063
MetadataPublished 2024-06-14
Related Molecule
Field Value
Measurement Technique liquid chromatography-mass spectrometry
Measurement Variables
Data-Source Molecule ID Data-Source
CHEMBL1895474 ChEMBL
C18399 KEGG Ligand
52741 ChEBI
HMDB0252014 Human Metabolome Database
J1.864C Nikkaji
29374 Brenda
MCULE-4131416773 Mcule
DTXSID7024085 EPA CompTox Dashboard
SCHEMBL37574 SureChEMBL
CB5210031 ChemicalBook
ZINC000003957753 ZINC
27982 PubChem
14842988 PubChem: Thomson Pharma
16672-87-0 ACToR
11672-87-0 ACToR
PD156625 ProbesDrugs
XU5R5VQ87S FDA SRS
509800 eMolecules
The data in this table is sourced from UniChem at EBI.