Dataset

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

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

Chemical Information

molecular Image
InChI InChI=1S/C14H14N2O2/c1-7-12-9(14(18)15-2)6-11(17)8-4-3-5-10(16-7)13(8)12/h3-5,9,16H,6H2,1-2H3,(H,15,18)
SMILES CNC(=O)C1CC(=O)c2c3c1c(C)[nH]c3ccc2
InChI Key QJYPGCPJNLNOJT-UHFFFAOYSA-N
Molecular Formula C14H14N2O2
Exact Mass 242.273 g/mol

Data and Resources

Metadata Information

Field Value
DOI 10.14272/QJYPGCPJNLNOJT-UHFFFAOYSA-N/CHMO0001146
License URL
Source https://www.chemotion-repository.net/inchikey/QJYPGCPJNLNOJT-UHFFFAOYSA-N/CHMO0001146
Version
Author Andreas Link
Maintainer Chemotion Repository
Language english
MetadataPublished 2024-10-14
Related Molecule
  • N,2-dimethyl-5-oxo-3,4-dihydro-1H-benzo[cd]indole-3-carboxamide
    • Field Value
    Measurement Technique 1H–13C heteronuclear single quantum coherence
    Measurement Variables
    title : FP

    date : 20210818

    starting time : 22.55

    Solvent : DMSO

    temperature : 298.2 K

    PULPROG : hsqcedetgpsisp2.2

    number of scans : 8 scans

    instrument : spect

    Data-Source Molecule ID Data-Source
    No additional information available for this Dataset.