Dataset
2-Phenylpyridine; LC-ESI-QFT; MS2; CE: 61.67%; R=35000; [M+H]+
Chemical Information
| InChI | InChI=1S/C11H9N/c1-2-6-10(7-3-1)11-8-4-5-9-12-11/h1-9H |
|---|---|
| SMILES | c1ccc(cc1)c2ccccn2 |
| InChI Key | VQGHOUODWALEFC-UHFFFAOYSA-N |
| Molecular Formula | C11H9N |
| Exact Mass | 155.073 g/mol |
Data and Resources
Metadata Information
| Field | Value |
|---|---|
| DOI | |
| License URL | https://creativecommons.org/licenses/by/4.0 |
| Source | https://massbank.eu/MassBank/RecordDisplay?id=MSBNK-UFZ-UA007801 |
| Version | |
| Author | |
| Maintainer | |
| Language | |
| MetadataPublished | 2017-08-17 |
| Related Molecule |
|
| Field | Value |
|---|---|
| Measurement Technique | liquid chromatography-mass spectrometry |
| Measurement Variables |
| Data-Source Molecule ID | Data-Source |
|---|---|
| CHEMBL1193163 | ChEMBL |
| 593459 | eMolecules |
| DTXSID6074417 | EPA CompTox Dashboard |
| HOJWIP | CCDC |
| HMDB0245295 | Human Metabolome Database |
| J45.968B | Nikkaji |
| 13887 | PubChem |
| 14818344 | PubChem: Thomson Pharma |
| 1008-89-5 | ACToR |
| SCHEMBL35754 | SureChEMBL |
| 2Y6S09838Q | FDA SRS |
| 10021722 | NMRShiftDB |
| MCULE-7213756255 | Mcule |
| ZINC000011535683 | ZINC |
| CB3332117 | ChemicalBook |
| The data in this table is sourced from UniChem at EBI. | |