Dataset

heteronuclear multiple bond coherence (HMBC)

dataset for heteronuclear multiple bond coherence (HMBC)\n\n

Chemical Info

molecular Image
InChI InChI=1S/C14H11ClN2/c1-10-7-12(15)14-16-13(9-17(14)8-10)11-5-3-2-4-6-11/h2-9H,1H3
SMILES Cc1cn2cc(nc2c(c1)Cl)c1ccccc1
InChI Key KLJOQBVCGLPIKO-UHFFFAOYSA-N
Molecular Formula C14H11ClN2
Exact Mass 242.704 g/mol

Data and Resources

Metadata Information

Field Value
DOI 10.14272/KLJOQBVCGLPIKO-UHFFFAOYSA-N/CHMO0000601
License URL
Source https://www.chemotion-repository.net/inchikey/KLJOQBVCGLPIKO-UHFFFAOYSA-N/CHMO0000601
Version
Author Simone Gräßle
Maintainer Chemotion Repository
Language english
MetadataCreated 2024-09-08T00:37:57.354535
MetadataModified 2024-09-08T00:37:57.354540
MetadataPublished 2023-03-03
Field Value
Measurement Technique heteronuclear multiple bond coherence
Measurement Variables
Data-Source Molecule ID Data-Source
166638641 PubChem
The data in this table is sourced from UniChem at EBI.