Dataset

13C nuclear magnetic resonance spectroscopy (13C NMR)

Chemical Information

InChI	InChI=1S/C13H17NO2/c1-16-13(15)12-8-5-9-14(12)10-11-6-3-2-4-7-11/h2-4,6-7,12H,5,8-10H2,1H3/t12-/m0/s1
SMILES	COC(=O)[C@@H]1CCCN1Cc1ccccc1
InChI Key	NGJACAHAGMHHQT-LBPRGKRZSA-N
Exact Mass	219.280 g/mol

Data and Resources

• 13C nuclear magnetic resonance spectroscopy (13C NMR)HTML
  Go to source

• 13c-nuclear-magneti...

Metadata Information

• Additional
• Measurement
• Molecule Data-Sources

Field	Value
DOI	10.14272/NGJACAHAGMHHQT-LBPRGKRZSA-N/CHMO0000595
License URL
Source	https://www.chemotion-repository.net/inchikey/NGJACAHAGMHHQT-LBPRGKRZSA-N/CHMO0000595
Version
Author	Thorsten Bach
Maintainer	Chemotion Repository
Language	english
MetadataPublished	2025-11-24
Related Molecule

Field	Value
Measurement Technique	13C nuclear magnetic resonance spectroscopy
Measurement Variables

Data-Source Molecule ID	Data-Source
952721	surechembl
11106861	pubchem
The data in this table is sourced from UniChem at EBI.