Dataset
Ambroxol; LC-ESI-Q; MS; POS; 30 V
Chemical Information
| InChI | InChI=1S/C13H18Br2N2O/c14-9-5-8(13(16)12(15)6-9)7-17-10-1-3-11(18)4-2-10/h5-6,10-11,17-18H,1-4,7,16H2/t10-,11- |
|---|---|
| SMILES | OC(C2)CCC(C2)NCc(c1)c(N)c(Br)cc(Br)1 |
| InChI Key | JBDGDEWWOUBZPM-XYPYZODXSA-N |
| Molecular Formula | C13H18Br2N2O |
| Exact Mass | 375.979 g/mol |
Data and Resources
Metadata Information
| Field | Value |
|---|---|
| DOI | |
| License URL | https://creativecommons.org/licenses/by-nc/4.0 |
| Source | https://massbank.eu/MassBank/RecordDisplay?id=MSBNK-Waters-WA001855 |
| Version | |
| Author | |
| Maintainer | |
| Language | |
| MetadataPublished | 2016-01-19 |
| Related Molecule |
|
| Field | Value |
|---|---|
| Measurement Technique | liquid chromatography-mass spectrometry |
| Measurement Variables |
| Data-Source Molecule ID | Data-Source |
|---|---|
| DB06742 | drugbank |
| CHEBI:135590 | chebi |
| CHEMBL153479 | chembl |
| 18702 | surechembl |
| 29380194 | surechembl |
| 200168S0CL | fdasrs |
| PD012068 | probes_and_drugs |
| FIYBEV | CCDC |
| 71010 | brenda |
| DTXSID8022583 | comptox |
| NCT00144274 | clinicaltrials |
| NCT00148499 | clinicaltrials |
| NCT00525044 | clinicaltrials |
| NCT01361802 | clinicaltrials |
| NCT01463215 | clinicaltrials |
| NCT01573663 | clinicaltrials |
| NCT01573663 | clinicaltrials |
| NCT01713179 | clinicaltrials |
| NCT02194257 | clinicaltrials |
| NCT02194257 | clinicaltrials |
| NCT02194270 | clinicaltrials |
| NCT02194283 | clinicaltrials |
| NCT02194296 | clinicaltrials |
| NCT02572609 | clinicaltrials |
| NCT02914366 | clinicaltrials |
| NCT02941822 | clinicaltrials |
| NCT03415269 | clinicaltrials |
| NCT03583658 | clinicaltrials |
| NCT03843541 | clinicaltrials |
| NCT03950050 | clinicaltrials |
| NCT04405596 | clinicaltrials |
| NCT04588285 | clinicaltrials |
| NCT05287503 | clinicaltrials |
| NCT05663905 | clinicaltrials |
| NCT05778617 | clinicaltrials |
| NCT05830396 | clinicaltrials |
| NCT05959850 | clinicaltrials |
| NCT06193421 | clinicaltrials |
| Molport-002-507-852 | molport |
| 147 | drugcentral |
| 50395322 | bindingdb |
| The data in this table is sourced from UniChem at EBI. | |