Dataset

13C nuclear magnetic resonance spectroscopy (13C NMR)

dataset for 13C nuclear magnetic resonance spectroscopy (13C NMR)\n\n

Chemical Info

molecular Image
InChI InChI=1S/C30H24N2/c1-2-6-28-25(5-1)20-27(29-7-3-4-18-31-29)30(32-28)26-19-23-13-12-21-8-10-22(11-9-21)14-16-24(26)17-15-23/h1-11,15,17-20H,12-14,16H2
SMILES c1ccc(nc1)c1cc2ccccc2nc1c1cc2CCc3ccc(CCc1cc2)cc3
InChI Key CFDUZKRCBFSQAH-UHFFFAOYSA-N
Exact Mass 412.525 g/mol

Data and Resources

Metadata Information

Field Value
DOI 10.14272/CFDUZKRCBFSQAH-UHFFFAOYSA-N/CHMO0000595
License URL
Source https://www.chemotion-repository.net/inchikey/CFDUZKRCBFSQAH-UHFFFAOYSA-N/CHMO0000595
Version
Author Tilman Hans Köhler
Maintainer Chemotion Repository
Language english
MetadataCreated 2024-09-08T03:35:50.314297
MetadataModified 2024-09-23T09:23:54.717149
MetadataPublished 2024-05-21
Field Value
Measurement Technique 13C nuclear magnetic resonance spectroscopy
Measurement Variables
Temperature : 298.0 K K

Puls programme : zgpg30

Number of scans : 1024

Title : Jan30-2024

Date : 20240131

Start time : 5.57 h

Instrument : Avance NEO

Label : KT-681

ID : 292863

Solvent : chloroform-D1 (CDCl3)

Data-Source Molecule ID Data-Source
No additional information available for this Dataset.