Dataset

1H--13C heteronuclear single quantum coherence (1H-13C HSQC)

dataset for 1H--13C heteronuclear single quantum coherence (1H-13C HSQC)\n\n

Chemical Info

molecular Image
InChI InChI=1S/C28H31BrN6/c1-27(2,3)32-25-23(30-21-11-7-9-13-34(21)25)18-15-19(17-20(29)16-18)24-26(33-28(4,5)6)35-14-10-8-12-22(35)31-24/h7-17,32-33H,1-6H3
SMILES Brc1cc(cc(c1)c1nc2n(c1NC(C)(C)C)cccc2)c1nc2n(c1NC(C)(C)C)cccc2
InChI Key WYOKKBFRYQMBFS-UHFFFAOYSA-N
Molecular Formula C28H31BrN6
Exact Mass 531.490 g/mol

Data and Resources

Metadata Information

Field Value
DOI 10.14272/WYOKKBFRYQMBFS-UHFFFAOYSA-N/CHMO0001146
License URL
Source https://www.chemotion-repository.net/inchikey/WYOKKBFRYQMBFS-UHFFFAOYSA-N/CHMO0001146
Version
Author Mareen Stahlberger
Maintainer Chemotion Repository
Language english
MetadataCreated 2024-09-08T01:40:32.238629
MetadataModified 2024-09-08T01:40:32.238634
MetadataPublished 2023-10-02
Field Value
Measurement Technique 1H–13C heteronuclear single quantum coherence
Measurement Variables
Data-Source Molecule ID Data-Source
168665439 PubChem
The data in this table is sourced from UniChem at EBI.