Dataset
1H--13C heteronuclear single quantum coherence (1H-13C HSQC)
Chemical Information
| InChI | InChI=1S/C18H12IN/c19-13-9-11-14(12-10-13)20-17-7-3-1-5-15(17)16-6-2-4-8-18(16)20/h1-12H |
|---|---|
| SMILES | Ic1ccc(cc1)n1c2ccccc2c2c1cccc2 |
| InChI Key | CWZDMKAGSIDFBR-UHFFFAOYSA-N |
| Exact Mass | 369.199 g/mol |
Data and Resources
Metadata Information
| Field | Value |
|---|---|
| DOI | 10.14272/CWZDMKAGSIDFBR-UHFFFAOYSA-N/CHMO0001146 |
| License URL | |
| Source | https://www.chemotion-repository.net/inchikey/CWZDMKAGSIDFBR-UHFFFAOYSA-N/CHMO0001146 |
| Version | |
| Author | Laura Holzhauer |
| Maintainer | Chemotion Repository |
| Language | english |
| MetadataPublished | 2025-10-22 |
| Related Molecule |
| Field | Value |
|---|---|
| Measurement Technique | CHMO:0001146 |
| Measurement Variables |
| Data-Source Molecule ID | Data-Source |
|---|---|
| 29351526 | surechembl |
| 536571 | surechembl |
| 10832858 | pubchem |
| LIZMEQ | CCDC |
| Molport-023-219-881 | molport |
| The data in this table is sourced from UniChem at EBI. | |