Dataset

2,6-Dichlorobenzamide

This MassBank record with Accession MSBNK-UFZ-UF405103 contains the MS2 mass spectrum of 2,6-Dichlorobenzamide with the InChIkey JHSPCUHPSIUQRB-UHFFFAOYSA-N.

Chemical Info

molecular Image
InChI InChI=1S/C7H5Cl2NO/c8-4-2-1-3-5(9)6(4)7(10)11/h1-3H,(H2,10,11)
SMILES NC(=O)C1=C(Cl)C=CC=C1Cl
InChI Key JHSPCUHPSIUQRB-UHFFFAOYSA-N
Molecular Formula C7H5Cl2NO
Exact Mass 188.975 g/mol

Data and Resources

Metadata Information

Field Value
DOI
License URL https://creativecommons.org/licenses/by/4.0
Source https://massbank.eu/MassBank/RecordDisplay?id=MSBNK-UFZ-UF405103
Version
Author
Maintainer
Language
MetadataCreated 2024-01-11T21:41:41.596411
MetadataModified 2025-02-09T19:48:55.641527
MetadataPublished 2017-01-05
Related Molecule
Field Value
Measurement Technique liquid chromatography-mass spectrometry
Measurement Variables
Data-Source Molecule ID Data-Source
16183 PubChem
16238858 PubChem: Thomson Pharma
SCHEMBL320037 SureChEMBL
2008-58-4 ACToR
501406 eMolecules
MTBLC28435 Metabolights
CB5272558 ChemicalBook
145225 Brenda
198554 Brenda
20039609 NMRShiftDB
E9JWF529EB FDA SRS
J29.504C Nikkaji
ECUKUJ CCDC
CHEMBL3184754 ChEMBL
DTXSID7022170 EPA CompTox Dashboard
MCULE-3690540095 Mcule
ZINC000000156529 ZINC
28435 ChEBI
C10934 KEGG Ligand
The data in this table is sourced from UniChem at EBI.