Dataset
process
Chemical Information
| InChI | InChI=1S/C9H12N2O2/c1-10(2)7-8-5-3-4-6-9(8)11(12)13/h3-6H,7H2,1-2H3 |
|---|---|
| SMILES | CN(Cc1ccccc1[N+](=O)[O-])C |
| InChI Key | FCAMUPIRWKNASD-UHFFFAOYSA-N |
| Molecular Formula | C9H12N2O2 |
| Exact Mass | 180.204 g/mol |
Data and Resources
Metadata Information
| Field | Value |
|---|---|
| DOI | 10.14272/FCAMUPIRWKNASD-UHFFFAOYSA-N/BFO0000015 |
| License URL | |
| Source | https://www.chemotion-repository.net/inchikey/FCAMUPIRWKNASD-UHFFFAOYSA-N/BFO0000015 |
| Version | |
| Author | Sonja Herres-Pawlis |
| Maintainer | Chemotion Repository |
| Language | english |
| MetadataPublished | 2020-02-28 |
| Related Molecule |
|
| Field | Value |
|---|---|
| Measurement Technique | process |
| Measurement Variables |
| Data-Source Molecule ID | Data-Source |
|---|---|
| SCHEMBL250143 | SureChEMBL |
| 420851 | PubChem |
| ZINC000001716744 | ZINC |
| The data in this table is sourced from UniChem at EBI. | |