Dataset
1H--13C heteronuclear single quantum coherence (1H-13C HSQC)
Chemical Info
| InChI | InChI=1S/C10H12BrN/c11-9-5-1-2-6-10(9)12-7-3-4-8-12/h1-2,5-6H,3-4,7-8H2 |
|---|---|
| SMILES | Brc1ccccc1N1CCCC1 |
| InChI Key | RSEPYQZONPBLLQ-UHFFFAOYSA-N |
| Molecular Formula | C10H12BrN |
| Exact Mass | 226.113 g/mol |
Data and Resources
Metadata Information
| Field | Value |
|---|---|
| DOI | 10.14272/RSEPYQZONPBLLQ-UHFFFAOYSA-N/CHMO0001146 |
| License URL | |
| Source | https://www.chemotion-repository.net/inchikey/RSEPYQZONPBLLQ-UHFFFAOYSA-N/CHMO0001146 |
| Version | |
| Author | Xuemin Gan |
| Maintainer | Chemotion Repository |
| Language | english |
| MetadataCreated | 2025-04-13T02:12:18.703056 |
| MetadataModified | 2025-04-13T02:12:18.703063 |
| MetadataPublished | 2025-04-09 |
| Related Molecule |