Dataset
Salicylic acid; LC-ESI-QTOF; MS2; 50 V
Chemical Information
| InChI | InChI=1S/C7H6O3/c8-6-4-2-1-3-5(6)7(9)10/h1-4,8H,(H,9,10) |
|---|---|
| SMILES | C1=CC=C(C(=C1)C(=O)O)O |
| InChI Key | YGSDEFSMJLZEOE-UHFFFAOYSA-N |
| Molecular Formula | C7H6O3 |
| Exact Mass | 138.032 g/mol |
Data and Resources
Metadata Information
| Field | Value |
|---|---|
| DOI | |
| License URL | |
| Source | https://massbank.eu/MassBank/RecordDisplay?id=MSBNK-BAFG-CSL23111011361 |
| Version | |
| Author | |
| Maintainer | |
| Language | |
| MetadataPublished | 2023-11-10 |
| Related Molecule |
|
| Field | Value |
|---|---|
| Measurement Technique | liquid chromatography-mass spectrometry |
| Measurement Variables |
| Data-Source Molecule ID | Data-Source |
|---|---|
| DB00936 | drugbank |
| CHEBI:16914 | chebi |
| SAL | rcsb_pdb |
| CHEMBL424 | chembl |
| 16880297 | surechembl |
| 1967 | surechembl |
| 29362663 | surechembl |
| 118212070 | pubchem |
| 338 | pubchem |
| O414PZ4LPZ | fdasrs |
| 4306 | gtopdb |
| PD001758 | probes_and_drugs |
| SALIAC | CCDC |
| 145569 | brenda |
| 21658 | brenda |
| 24601 | brenda |
| 47420 | brenda |
| 5097 | brenda |
| 617 | brenda |
| 765 | brenda |
| 90999 | brenda |
| SAL | pdbe |
| HMDB0001895 | hmdb |
| DTXSID7026368 | comptox |
| NCT00143819 | clinicaltrials |
| NCT00361322 | clinicaltrials |
| NCT00425074 | clinicaltrials |
| NCT00501059 | clinicaltrials |
| NCT00501254 | clinicaltrials |
| NCT00616239 | clinicaltrials |
| NCT01004705 | clinicaltrials |
| NCT01012349 | clinicaltrials |
| NCT01033526 | clinicaltrials |
| NCT01046942 | clinicaltrials |
| NCT01059110 | clinicaltrials |
| NCT01062360 | clinicaltrials |
| NCT01072604 | clinicaltrials |
| NCT01081353 | clinicaltrials |
| NCT01139749 | clinicaltrials |
| NCT01141153 | clinicaltrials |
| NCT01228656 | clinicaltrials |
| NCT01229085 | clinicaltrials |
| NCT01294462 | clinicaltrials |
| NCT01361399 | clinicaltrials |
| NCT01362218 | clinicaltrials |
| NCT01409616 | clinicaltrials |
| NCT01424332 | clinicaltrials |
| NCT01446237 | clinicaltrials |
| NCT01453400 | clinicaltrials |
| NCT01494402 | clinicaltrials |
| NCT01552798 | clinicaltrials |
| NCT01586819 | clinicaltrials |
| NCT01706250 | clinicaltrials |
| NCT01706263 | clinicaltrials |
| NCT01914627 | clinicaltrials |
| NCT02022527 | clinicaltrials |
| NCT02052752 | clinicaltrials |
| NCT02151630 | clinicaltrials |
| NCT02268773 | clinicaltrials |
| NCT02273505 | clinicaltrials |
| NCT02285153 | clinicaltrials |
| NCT02289768 | clinicaltrials |
| NCT02313909 | clinicaltrials |
| NCT02352987 | clinicaltrials |
| NCT02352987 | clinicaltrials |
| NCT02524665 | clinicaltrials |
| NCT02812719 | clinicaltrials |
| NCT03056703 | clinicaltrials |
| NCT03447925 | clinicaltrials |
| NCT03456154 | clinicaltrials |
| NCT03503227 | clinicaltrials |
| NCT03710174 | clinicaltrials |
| NCT03832647 | clinicaltrials |
| NCT04192955 | clinicaltrials |
| NCT04490967 | clinicaltrials |
| NCT04846348 | clinicaltrials |
| NCT05536193 | clinicaltrials |
| NCT05588999 | clinicaltrials |
| NCT05684484 | clinicaltrials |
| NCT06307223 | clinicaltrials |
| Molport-001-769-476 | molport |
| 2416 | drugcentral |
| 26193 | bindingdb |
| The data in this table is sourced from UniChem at EBI. | |