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/C16H21NO3/c1-16(2,3)15(18)17-8-7-12-5-6-13(11-14(12)17)20-10-9-19-4/h5-8,11H,9-10H2,1-4H3
SMILES COCCOc1ccc2c(c1)n(cc2)C(=O)C(C)(C)C
InChI Key BDDJVWLAZKXGQJ-UHFFFAOYSA-N
Molecular Formula C16H21NO3
Exact Mass 275.343 g/mol

Data and Resources

Metadata Information

Field Value
DOI 10.14272/BDDJVWLAZKXGQJ-UHFFFAOYSA-N/CHMO0000595
License URL
Source https://www.chemotion-repository.net/inchikey/BDDJVWLAZKXGQJ-UHFFFAOYSA-N/CHMO0000595
Version
Author Niklas Krappel
Maintainer Chemotion Repository
Language english
MetadataCreated 2024-09-08T01:16:15.149832
MetadataModified 2024-09-08T01:16:15.149837
MetadataPublished 2023-07-31
Field Value
Measurement Technique 13C nuclear magnetic resonance spectroscopy
Measurement Variables