Dataset

heteronuclear single quantum coherence total correlation spectroscopy (HSQC-TOCSY)

dataset for heteronuclear single quantum coherence total correlation spectroscopy (HSQC-TOCSY)\n\n

Chemical Info

molecular Image
InChI InChI=1S/C26H30BrN/c1-25(2,3)19-7-13-22(14-8-19)28(24-17-11-21(27)12-18-24)23-15-9-20(10-16-23)26(4,5)6/h7-18H,1-6H3
SMILES Brc1ccc(cc1)N(c1ccc(cc1)C(C)(C)C)c1ccc(cc1)C(C)(C)C
InChI Key NPGGLZWVRNBLFX-UHFFFAOYSA-N
Molecular Formula C26H30BrN
Exact Mass 436.427 g/mol

Data and Resources

Metadata Information

Field Value
DOI 10.14272/NPGGLZWVRNBLFX-UHFFFAOYSA-N/CHMO0001071
License URL
Source https://www.chemotion-repository.net/inchikey/NPGGLZWVRNBLFX-UHFFFAOYSA-N/CHMO0001071
Version
Author Steffen Otterbach
Maintainer Chemotion Repository
Language english
MetadataCreated 2024-09-08T01:54:37.482022
MetadataModified 2024-09-08T01:54:37.482027
MetadataPublished 2023-11-13
Field Value
Measurement Technique heteronuclear single quantum coherence total correlation spectroscopy
Measurement Variables
Data-Source Molecule ID Data-Source
59793446 PubChem
J3.195.761C Nikkaji
SCHEMBL9956810 SureChEMBL
The data in this table is sourced from UniChem at EBI.