Dataset

heteronuclear multiple bond coherence (HMBC)

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

Chemical Info

molecular Image
InChI InChI=1S/C22H15NO/c1-2-10-17-16(8-1)9-7-13-18(17)23-19-11-3-5-14-21(19)24-22-15-6-4-12-20(22)23/h1-15H
SMILES c1ccc2c(c1)Oc1c(N2c2cccc3c2cccc3)cccc1
InChI Key WXBQPLNOHBEVJJ-UHFFFAOYSA-N
Molecular Formula C22H15NO
Exact Mass 309.361 g/mol

Data and Resources

Metadata Information

Field Value
DOI 10.14272/WXBQPLNOHBEVJJ-UHFFFAOYSA-N/CHMO0000601
License URL
Source https://www.chemotion-repository.net/inchikey/WXBQPLNOHBEVJJ-UHFFFAOYSA-N/CHMO0000601
Version
Author Fabian Schönle
Maintainer Chemotion Repository
Language english
MetadataCreated 2024-09-08T03:56:43.329085
MetadataModified 2024-09-08T03:56:43.329091
MetadataPublished 2024-06-28
Field Value
Measurement Technique heteronuclear multiple bond coherence
Measurement Variables
Data-Source Molecule ID Data-Source
POJBEZ CCDC
129057455 PubChem
SCHEMBL18770825 SureChEMBL
J3.660.336D Nikkaji
The data in this table is sourced from UniChem at EBI.