Dataset

1H nuclear magnetic resonance spectroscopy (1H NMR)

dataset for 1H nuclear magnetic resonance spectroscopy (1H NMR)

Chemical Information

molecular Image
InChI InChI=1S/C10H11N/c1-4-9-5-7-10(8-6-9)11(2)3/h1,5-8H,2-3H3
SMILES C#Cc1ccc(cc1)N(C)C
InChI Key ZWMAYLMVFSCMMS-UHFFFAOYSA-N
Molecular Formula C10H11N
Exact Mass 145.201 g/mol

Data and Resources

Metadata Information

Field Value
DOI 10.14272/ZWMAYLMVFSCMMS-UHFFFAOYSA-N/CHMO0000593
License URL
Source https://www.chemotion-repository.net/inchikey/ZWMAYLMVFSCMMS-UHFFFAOYSA-N/CHMO0000593
Version
Author Simone Gräßle
Maintainer Chemotion Repository
Language english
MetadataPublished 2023-11-03
Related Molecule
  • 4-ethynyl-N,N-dimethylaniline
    • Field Value
    Measurement Technique 1H nuclear magnetic resonance spectroscopy
    Measurement Variables
    Data-Source Molecule ID Data-Source
    186079 surechembl
    5191884 pubchem
    GENLAN CCDC
    Molport-002-499-413 molport
    The data in this table is sourced from UniChem at EBI.