Dataset

heteronuclear multiple bond coherence (HMBC)

dataset for heteronuclear multiple bond coherence (HMBC)\n\n

Chemical Info

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/CHMO0000601
License URL
Source https://www.chemotion-repository.net/inchikey/ZWMAYLMVFSCMMS-UHFFFAOYSA-N/CHMO0000601
Version
Author Simone Gräßle
Maintainer Chemotion Repository
Language english
MetadataCreated 2024-09-08T01:50:06.745842
MetadataModified 2024-09-08T01:50:06.745847
MetadataPublished 2023-11-03
Field Value
Measurement Technique heteronuclear multiple bond coherence
Measurement Variables
Data-Source Molecule ID Data-Source
523918 eMolecules
16226058 PubChem: Thomson Pharma
5191884 PubChem
SCHEMBL186079 SureChEMBL
ZINC000002534480 ZINC
CB7421725 ChemicalBook
GENLAN CCDC
J719.527C Nikkaji
The data in this table is sourced from UniChem at EBI.