Dataset
mass spectrometry (MS)
Chemical Info
InChI | InChI=1S/C11H10N2/c12-11-4-2-1-3-10(11)9-5-7-13-8-6-9/h1-8H,12H2 |
---|---|
SMILES | Nc1ccccc1c1ccncc1 |
InChI Key | ODRIUFNOBKDEJX-UHFFFAOYSA-N |
Molecular Formula | C11H10N2 |
Exact Mass | 170.210 g/mol |
Data and Resources
Metadata Information
Field | Value |
---|---|
DOI | 10.14272/ODRIUFNOBKDEJX-UHFFFAOYSA-N/CHMO0000470 |
License URL | |
Source | https://www.chemotion-repository.net/inchikey/ODRIUFNOBKDEJX-UHFFFAOYSA-N/CHMO0000470 |
Version | |
Author | Stefan Bräse |
Maintainer | Chemotion Repository |
Language | english |
MetadataCreated | 2024-09-08T00:45:41.504604 |
MetadataModified | 2024-09-08T00:45:41.504609 |
MetadataPublished | 2023-03-06 |
Field | Value |
---|---|
Measurement Technique | mass spectrometry |
Measurement Variables |
Data-Source Molecule ID | Data-Source |
---|---|
SCHEMBL396362 | SureChEMBL |
13192373 | eMolecules |
MCULE-8208997689 | Mcule |
13546446 | PubChem |
DTXSID00543422 | EPA CompTox Dashboard |
ZINC000026897742 | ZINC |
The data in this table is sourced from UniChem at EBI. |