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/C22H18N2/c1-15-16(2)24-22-14-20(18-11-7-4-8-12-18)19(13-21(22)23-15)17-9-5-3-6-10-17/h3-14H,1-2H3
SMILES Cc1nc2cc(c3ccccc3)c(cc2nc1C)c1ccccc1
InChI Key BRRNXIZKXCRBRX-UHFFFAOYSA-N
Molecular Formula C22H18N2
Exact Mass 310.392 g/mol

Data and Resources

Metadata Information

Field Value
DOI 10.14272/BRRNXIZKXCRBRX-UHFFFAOYSA-N/CHMO0000593
License URL
Source https://www.chemotion-repository.net/inchikey/BRRNXIZKXCRBRX-UHFFFAOYSA-N/CHMO0000593
Version
Author Jérôme Klein
Maintainer Chemotion Repository
Language english
MetadataCreated 2024-09-07T06:41:25.077495
MetadataModified 2024-09-07T22:16:06.805364
MetadataPublished 2022-04-17
Related Molecule
Field Value
Measurement Technique 1H nuclear magnetic resonance spectroscopy
Measurement Variables
Data-Source Molecule ID Data-Source
163197223 PubChem
The data in this table is sourced from UniChem at EBI.