Dataset
Benzophenone; LC-ESI-QTOF; MS2; 40 V
Chemical Information
| InChI | InChI=1S/C13H10O/c14-13(11-7-3-1-4-8-11)12-9-5-2-6-10-12/h1-10H |
|---|---|
| SMILES | O=C(c1ccccc1)c2ccccc2 |
| InChI Key | RWCCWEUUXYIKHB-UHFFFAOYSA-N |
| Molecular Formula | C13H10O |
| Exact Mass | 182.073 g/mol |
Data and Resources
Metadata Information
| Field | Value |
|---|---|
| DOI | |
| License URL | |
| Source | https://massbank.eu/MassBank/RecordDisplay?id=MSBNK-BAFG-CSL2311094925 |
| Version | |
| Author | |
| Maintainer | |
| Language | |
| MetadataPublished | 2023-11-09 |
| Related Molecule |
|
| Field | Value |
|---|---|
| Measurement Technique | liquid chromatography-mass spectrometry |
| Measurement Variables |
| Data-Source Molecule ID | Data-Source |
|---|---|
| DB01878 | drugbank |
| BZQ | rcsb_pdb |
| CHEMBL90039 | chembl |
| 1087699 | surechembl |
| 17745 | surechembl |
| 2843203 | surechembl |
| 3102 | pubchem |
| 701M4TTV9O | fdasrs |
| BZQ | pdbe |
| CHEBI:41308 | rhea |
| PD009431 | probes_and_drugs |
| BPHENO | CCDC |
| 260404 | brenda |
| 7654 | brenda |
| HMDB0032049 | hmdb |
| Molport-000-872-026 | molport |
| 22726 | bindingdb |
| The data in this table is sourced from UniChem at EBI. | |