Dataset

1H nuclear magnetic resonance spectroscopy (1H NMR)

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

Chemical Information

molecular Image
InChI InChI=1S/C24H25NO/c26-24(21-13-6-2-7-14-21,22-15-8-3-9-16-22)23-17-10-18-25(23)19-20-11-4-1-5-12-20/h1-9,11-16,23,26H,10,17-19H2/t23-/m0/s1
SMILES OC([C@@H]1CCCN1Cc1ccccc1)(c1ccccc1)c1ccccc1
InChI Key AZOXPIPWRDWNBA-QHCPKHFHSA-N
Exact Mass 343.461 g/mol

Data and Resources

Metadata Information

Field Value
DOI 10.14272/AZOXPIPWRDWNBA-QHCPKHFHSA-N/CHMO0000593
License URL
Source https://www.chemotion-repository.net/inchikey/AZOXPIPWRDWNBA-QHCPKHFHSA-N/CHMO0000593
Version
Author Thorsten Bach
Maintainer Chemotion Repository
Language english
MetadataPublished 2025-11-24
Related Molecule
Field Value
Measurement Technique 1H nuclear magnetic resonance spectroscopy
Measurement Variables
Data-Source Molecule ID Data-Source
CHEMBL4908363 chembl
20128479 surechembl
1260655 pubchem
GELROE CCDC
DTXSID60361407 comptox
Molport-027-836-286 molport
The data in this table is sourced from UniChem at EBI.