Dataset

heteronuclear multiple bond coherence (HMBC)

dataset for heteronuclear multiple bond coherence (HMBC)

Chemical Information

molecular Image
InChI InChI=1S/C11H13N5O4/c1-3-19-11(18)9-4-12-14-10(9)16-5-8(13-15-16)6-20-7(2)17/h4-5H,3,6H2,1-2H3,(H,12,14)
SMILES CCOC(=O)c1c[nH]nc1n1nnc(c1)COC(=O)C
InChI Key RJHHGQMRVYAAGU-UHFFFAOYSA-N
Molecular Formula C11H13N5O4
Exact Mass 279.252 g/mol

Data and Resources

Metadata Information

Field Value
DOI 10.14272/RJHHGQMRVYAAGU-UHFFFAOYSA-N/CHMO0000601
License URL
Source https://www.chemotion-repository.net/inchikey/RJHHGQMRVYAAGU-UHFFFAOYSA-N/CHMO0000601
Version
Author Nicolai Wippert
Maintainer Chemotion Repository
Language english
MetadataPublished 2024-02-14
Related Molecule
  • ethyl 5-[4-(acetyloxymethyl)triazol-1-yl]-1H-pyrazole-4-carboxylate
    • Field Value
    Measurement Technique heteronuclear multiple bond coherence
    Measurement Variables
    Data-Source Molecule ID Data-Source
    No additional information available for this Dataset.