Dataset

heteronuclear multiple bond coherence (HMBC)

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

Chemical Info

molecular Image
InChI InChI=1S/C14H11FN2/c1-10-5-4-8-17-9-13(16-14(10)17)11-6-2-3-7-12(11)15/h2-9H,1H3
SMILES Fc1ccccc1c1cn2c(n1)c(C)ccc2
InChI Key HFJDLAHRMQHDEB-UHFFFAOYSA-N
Molecular Formula C14H11FN2
Exact Mass 226.249 g/mol

Data and Resources

Metadata Information

Field Value
DOI 10.14272/HFJDLAHRMQHDEB-UHFFFAOYSA-N/CHMO0000601
License URL
Source https://www.chemotion-repository.net/inchikey/HFJDLAHRMQHDEB-UHFFFAOYSA-N/CHMO0000601
Version
Author Simone Gräßle
Maintainer Chemotion Repository
Language english
MetadataCreated 2024-09-08T00:43:03.667048
MetadataModified 2024-09-08T00:43:03.667054
MetadataPublished 2023-03-03
Field Value
Measurement Technique heteronuclear multiple bond coherence
Measurement Variables
Data-Source Molecule ID Data-Source
71628504 PubChem
ZINC000095082350 ZINC
The data in this table is sourced from UniChem at EBI.