Dataset
2-Hydroxycarbamazepine; LC-ESI-ITFT; MS2; CE: 35; R=15000; [M+H]+
Chemical Information
| InChI | InChI=1S/C15H12N2O2/c16-15(19)17-13-4-2-1-3-10(13)5-6-11-9-12(18)7-8-14(11)17/h1-9,18H,(H2,16,19) |
|---|---|
| SMILES | NC(=O)N1C2=CC=CC=C2C=CC2=CC(O)=CC=C12 |
| InChI Key | VPZIYMMSJFWLSP-UHFFFAOYSA-N |
| Molecular Formula | C15H12N2O2 |
| Exact Mass | 252.090 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-UF411103 |
| Version | |
| Author | |
| Maintainer | |
| Language | |
| MetadataPublished | 2017-01-05 |
| Related Molecule |
|
| Field | Value |
|---|---|
| Measurement Technique | liquid chromatography-mass spectrometry |
| Measurement Variables |
| Data-Source Molecule ID | Data-Source |
|---|---|
| CHEBI:80596 | chebi |
| CHEMBL3103396 | chembl |
| 2738798 | surechembl |
| 129274 | pubchem |
| 1UT0PR32AJ | fdasrs |
| HMDB0060651 | hmdb |
| 51089200 | bindingdb |
| The data in this table is sourced from UniChem at EBI. | |