Dataset

1H--13C heteronuclear multiple bond coherence (13C-1H HMBC)

dataset for 1H--13C heteronuclear multiple bond coherence (13C-1H HMBC)\n\n

Chemical Info

molecular Image
InChI InChI=1S/C29H31N3/c1-2-6-25(7-3-1)30-29-28(31-27-8-4-5-19-32(27)29)26-20-23-14-13-21-9-11-22(12-10-21)15-17-24(26)18-16-23/h4-5,8-12,16,18-20,25,30H,1-3,6-7,13-15,17H2
SMILES C1CCC(CC1)Nc1c(nc2n1cccc2)c1cc2CCc3ccc(CCc1cc2)cc3
InChI Key DYPLZUUJBAHQNP-UHFFFAOYSA-N
Molecular Formula C29H31N3
Exact Mass 421.577 g/mol

Data and Resources

Metadata Information

Field Value
DOI 10.14272/DYPLZUUJBAHQNP-UHFFFAOYSA-N/CHMO0001148
License URL
Source https://www.chemotion-repository.net/inchikey/DYPLZUUJBAHQNP-UHFFFAOYSA-N/CHMO0001148
Version
Author Mareen Stahlberger
Maintainer Chemotion Repository
Language english
MetadataCreated 2024-09-07T07:02:08.308271
MetadataModified 2024-09-07T22:35:45.976440
MetadataPublished 2022-07-25
Field Value
Measurement Technique 1H–13C heteronuclear multiple bond coherence
Measurement Variables
Data-Source Molecule ID Data-Source
164889659 PubChem
The data in this table is sourced from UniChem at EBI.