Dataset

1H--1H correlation spectroscopy (1H-1H COSY)

dataset for 1H--1H correlation spectroscopy (1H-1H COSY)\n\n

Chemical Info

molecular Image
InChI InChI=1S/C19H22BrN3/c1-12-10-14(11-13(2)16(12)20)17-18(22-19(3,4)5)23-9-7-6-8-15(23)21-17/h6-11,22H,1-5H3
SMILES Cc1cc(cc(c1Br)C)c1nc2n(c1NC(C)(C)C)cccc2
InChI Key BPYJNKXACMKJPW-UHFFFAOYSA-N
Molecular Formula C19H22BrN3
Exact Mass 372.302 g/mol

Data and Resources

Metadata Information

Field Value
DOI 10.14272/BPYJNKXACMKJPW-UHFFFAOYSA-N/CHMO0001150
License URL
Source https://www.chemotion-repository.net/inchikey/BPYJNKXACMKJPW-UHFFFAOYSA-N/CHMO0001150
Version
Author Mareen Stahlberger
Maintainer Chemotion Repository
Language english
MetadataCreated 2024-09-08T01:41:51.864312
MetadataModified 2024-09-08T01:41:51.864317
MetadataPublished 2023-10-02
Field Value
Measurement Technique 1H–1H correlation spectroscopy
Measurement Variables
Data-Source Molecule ID Data-Source
168665440 PubChem
The data in this table is sourced from UniChem at EBI.