Dataset
1H--13C heteronuclear multiple bond coherence (13C-1H HMBC)
Chemical Info
| InChI | InChI=1S/C9H10BrN/c10-9-3-1-2-7-4-5-11-6-8(7)9/h1-3,11H,4-6H2 |
|---|---|
| SMILES | Brc1cccc2c1CNCC2 |
| InChI Key | KHWGHUZYXQPIKA-UHFFFAOYSA-N |
| Molecular Formula | C9H10BrN |
| Exact Mass | 212.086 g/mol |
Data and Resources
Metadata Information
| Field | Value |
|---|---|
| DOI | 10.14272/KHWGHUZYXQPIKA-UHFFFAOYSA-N/CHMO0001148 |
| License URL | |
| Source | https://www.chemotion-repository.net/inchikey/KHWGHUZYXQPIKA-UHFFFAOYSA-N/CHMO0001148 |
| Version | |
| Author | Jana Alpin |
| Maintainer | Chemotion Repository |
| Language | english |
| MetadataCreated | 2025-02-04T13:26:02.208437 |
| MetadataModified | 2025-02-04T13:26:02.208443 |
| MetadataPublished | 2025-01-08 |
| Related Molecule |