Dataset

1H nuclear magnetic resonance spectroscopy (1H NMR)

dataset for 1H nuclear magnetic resonance spectroscopy (1H NMR)

Chemical Information

molecular Image
InChI InChI=1S/C23H26/c1-23(2,3)22-15-21(22)20-14-18-9-8-16-4-6-17(7-5-16)10-12-19(20)13-11-18/h4-7,11,13-15,21H,8-10,12H2,1-3H3
SMILES CC(C1=CC1c1cc2ccc1CCc1ccc(CC2)cc1)(C)C
InChI Key FKSBFEVPBXWWSQ-UHFFFAOYSA-N
Exact Mass 302.453 g/mol

Data and Resources

Metadata Information

Field Value
DOI 10.14272/FKSBFEVPBXWWSQ-UHFFFAOYSA-N/CHMO0000593
License URL
Source https://www.chemotion-repository.net/inchikey/FKSBFEVPBXWWSQ-UHFFFAOYSA-N/CHMO0000593
Version
Author Tilman Hans Köhler
Maintainer Chemotion Repository
Language english
MetadataPublished 2026-01-20
Related Molecule
Field Value
Measurement Technique 1H nuclear magnetic resonance spectroscopy
Measurement Variables
date : 2024-11-07

starting time : 08:33:31 UTC

creator : Tilman Köhler

label : KT-1199

id : 332484

Solvent : CD2Cl2

temperature : 297.9992 K

PULPROG : zg30

number of scans : 16 scans

instrument : Avance NEO

Name : TopSpin

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