Dataset

1H--13C heteronuclear single quantum coherence (1H-13C HSQC)

dataset for 1H--13C heteronuclear single quantum coherence (1H-13C HSQC)\n\n

Chemical Info

molecular Image
InChI InChI=1S/C13H15NO2/c15-7-11-5-10-3-4-12(6-13(10)14-11)16-8-9-1-2-9/h3-6,9,14-15H,1-2,7-8H2
SMILES OCc1cc2c([nH]1)cc(cc2)OCC1CC1
InChI Key LUENMAYUYMFEPN-UHFFFAOYSA-N
Molecular Formula C13H15NO2
Exact Mass 217.264 g/mol

Data and Resources

Metadata Information

Field Value
DOI 10.14272/LUENMAYUYMFEPN-UHFFFAOYSA-N/CHMO0001146
License URL
Source https://www.chemotion-repository.net/inchikey/LUENMAYUYMFEPN-UHFFFAOYSA-N/CHMO0001146
Version
Author Niklas Krappel
Maintainer Chemotion Repository
Language english
MetadataCreated 2024-09-08T01:17:48.426515
MetadataModified 2024-09-08T01:17:48.426521
MetadataPublished 2023-07-31
Field Value
Measurement Technique 1H–13C heteronuclear single quantum coherence
Measurement Variables
Data-Source Molecule ID Data-Source
SCHEMBL3626472 SureChEMBL
57608295 PubChem
The data in this table is sourced from UniChem at EBI.