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/C12H15NO3/c1-3-13-11(14)9-5-7-10(8-6-9)12(15)16-4-2/h5-8H,3-4H2,1-2H3,(H,13,14)
SMILES CCNC(=O)c1ccc(cc1)C(=O)OCC
InChI Key AUTDBLDMAFLPOF-UHFFFAOYSA-N
Molecular Formula C12H15NO3
Exact Mass 221.252 g/mol

Data and Resources

Metadata Information

Field Value
DOI 10.14272/AUTDBLDMAFLPOF-UHFFFAOYSA-N/NMR/13C/CDCl3/62.5.1
License URL
Source https://www.chemotion-repository.net/inchikey/AUTDBLDMAFLPOF-UHFFFAOYSA-N/NMR/13C/CDCl3/62.5.1
Version
Author Simone Gräßle
Maintainer Chemotion Repository
Language english
MetadataCreated 2024-09-06T21:29:24.913934
MetadataModified 2024-09-07T14:00:17.370346
MetadataPublished 2015-05-11
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