Dataset
Biphenyl; GC-APCI-QTOF; MS2; CE: 40 eV; R=35000; [M]+
Chemical Information
| InChI | InChI=1S/C12H10/c1-3-7-11(8-4-1)12-9-5-2-6-10-12/h1-10H |
|---|---|
| SMILES | C1=CC=C(C=C1)C2=CC=CC=C2 |
| InChI Key | ZUOUZKKEUPVFJK-UHFFFAOYSA-N |
| Molecular Formula | C12H10 |
| Exact Mass | 154.078 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-Athens_Univ-AU504009 |
| Version | |
| Author | |
| Maintainer | |
| Language | |
| MetadataPublished | 2021-04-20 |
| Related Molecule |
|
| Field | Value |
|---|---|
| Measurement Technique | liquid chromatography-mass spectrometry |
| Measurement Variables |
| Data-Source Molecule ID | Data-Source |
|---|---|
| CHEBI:17097 | chebi |
| BNL | rcsb_pdb |
| CHEMBL14092 | chembl |
| 164 | surechembl |
| 3679529 | surechembl |
| 7095 | pubchem |
| 2L9GJK6MGN | fdasrs |
| PD144582 | probes_and_drugs |
| BIPHEN | CCDC |
| 107817 | brenda |
| 1885 | brenda |
| HMDB0034437 | hmdb |
| Molport-001-738-537 | molport |
| 50168002 | bindingdb |
| The data in this table is sourced from UniChem at EBI. | |