Dataset

heteronuclear multiple bond coherence (HMBC)

dataset for heteronuclear multiple bond coherence (HMBC)

Chemical Information

molecular Image
InChI InChI=1S/C7H8/c1-3-5-7-6-4-2/h1-2H,5-7H2
SMILES C#CCCCC#C
InChI Key RSPZSDWVQWRAEF-UHFFFAOYSA-N
Molecular Formula C7H8
Exact Mass 92.138 g/mol

Data and Resources

Metadata Information

Field Value
DOI 10.14272/RSPZSDWVQWRAEF-UHFFFAOYSA-N/CHMO0000601
License URL
Source https://www.chemotion-repository.net/inchikey/RSPZSDWVQWRAEF-UHFFFAOYSA-N/CHMO0000601
Version
Author Simone Gräßle
Maintainer Chemotion Repository
Language english
MetadataPublished 2024-09-06
Related Molecule
  • hepta-1,6-diyne
    • Field Value
    Measurement Technique heteronuclear multiple bond coherence
    Measurement Variables
    Data-Source Molecule ID Data-Source
    973460 surechembl
    337121 pubchem
    4Q2T7VS4RE fdasrs
    Molport-002-497-849 molport
    The data in this table is sourced from UniChem at EBI.