Dataset

heteronuclear multiple bond coherence (HMBC)

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

Chemical Info

molecular Image
InChI InChI=1S/C14H10ClFN2/c1-9-6-11(15)14-17-13(8-18(14)7-9)10-4-2-3-5-12(10)16/h2-8H,1H3
SMILES Cc1cn2cc(nc2c(c1)Cl)c1ccccc1F
InChI Key MNWHHCRXBACDMO-UHFFFAOYSA-N
Molecular Formula C14H10ClFN2
Exact Mass 260.694 g/mol

Data and Resources

Metadata Information

Field Value
DOI 10.14272/MNWHHCRXBACDMO-UHFFFAOYSA-N/CHMO0000601
License URL
Source https://www.chemotion-repository.net/inchikey/MNWHHCRXBACDMO-UHFFFAOYSA-N/CHMO0000601
Version
Author Simone Gräßle
Maintainer Chemotion Repository
Language english
MetadataCreated 2024-09-08T00:44:37.415084
MetadataModified 2024-09-08T00:44:37.415090
MetadataPublished 2023-03-03
Field Value
Measurement Technique heteronuclear multiple bond coherence
Measurement Variables
Data-Source Molecule ID Data-Source
166638640 PubChem
The data in this table is sourced from UniChem at EBI.