Dataset

1H nuclear magnetic resonance spectroscopy (1H NMR)

dataset for 1H nuclear magnetic resonance spectroscopy (1H NMR)\n\n

Chemical Info

molecular Image
InChI InChI=1S/C10H6Cl2N2/c11-9-5-8(6-10(12)14-9)7-1-3-13-4-2-7/h1-6H
SMILES Clc1nc(Cl)cc(c1)c1ccncc1
InChI Key FLZJZVAEYWUCET-UHFFFAOYSA-N
Molecular Formula C10H6Cl2N2
Exact Mass 225.074 g/mol

Data and Resources

Metadata Information

Field Value
DOI 10.14272/FLZJZVAEYWUCET-UHFFFAOYSA-N/CHMO0000593
License URL
Source https://www.chemotion-repository.net/inchikey/FLZJZVAEYWUCET-UHFFFAOYSA-N/CHMO0000593
Version
Author Hannes Kühner
Maintainer Chemotion Repository
Language english
MetadataCreated 2024-09-07T06:54:53.708203
MetadataModified 2024-09-07T22:26:50.366556
MetadataPublished 2022-07-09
Related Molecule
Field Value
Measurement Technique 1H nuclear magnetic resonance spectroscopy
Measurement Variables
Data-Source Molecule ID Data-Source
71338980 PubChem
DTXSID30766485 EPA CompTox Dashboard
SCHEMBL4719469 SureChEMBL
J3.404.758H Nikkaji
The data in this table is sourced from UniChem at EBI.