Dataset

13C nuclear magnetic resonance spectroscopy (13C NMR)

dataset for 13C nuclear magnetic resonance spectroscopy (13C NMR)

Chemical Information

molecular Image
InChI InChI=1S/C16H13NO5/c1-21-15(18)11-5-3-10(4-6-11)13-8-7-12(16(19)22-2)9-14(13)17-20/h3-9H,1-2H3
SMILES COC(=O)c1ccc(cc1)c1ccc(cc1N=O)C(=O)OC
InChI Key CSHSZEDKQYNPIZ-UHFFFAOYSA-N
Molecular Formula C16H13NO5
Exact Mass 299.278 g/mol

Data and Resources

Metadata Information

Field Value
DOI 10.14272/CSHSZEDKQYNPIZ-UHFFFAOYSA-N/13CNMR
License URL
Source https://www.chemotion-repository.net/inchikey/CSHSZEDKQYNPIZ-UHFFFAOYSA-N/13CNMR
Version
Author Patrick Hodapp
Maintainer Chemotion Repository
Language english
MetadataPublished 2019-05-23
Related Molecule
  • methyl 4-(4-methoxycarbonylphenyl)-3-nitrosobenzoate
    • Field Value
    Measurement Technique 13C nuclear magnetic resonance spectroscopy
    Measurement Variables
    Data-Source Molecule ID Data-Source
    91757969 PubChem
    The data in this table is sourced from UniChem at EBI.