Molecule
![Molecular Image]()
13C nuclear magnetic resonance spectroscopy (13C NMR)
1H nuclear magnetic resonance spectroscopy (1H NMR)
atmospheric pressure chemical ionisation mass spectrometry (APCI MS)
3-hydroxy-3-(4-methoxyphenyl)-2H-isoindol-1-one
Chemical Information
| InChI | InChI=1S/C15H13NO3/c1-19-11-8-6-10(7-9-11)15(18)13-5-3-2-4-12(13)14(17)16-15/h2-9,18H,1H3,(H,16,17) |
|---|---|
| SMILES | COc1ccc(cc1)C1(O)NC(=O)c2c1cccc2 |
| InChI Key | LUFCKFOOXDPWBV-UHFFFAOYSA-N |
| Exact Mass | 255.269 g/mol |
3 Related Dataset(s)
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Metadata Information
| Field | Value |
|---|---|
| NFDI4Chem Molecule ID | nfdi4chem-mol8167 |
| Source | |
| Alternate Name |
| Field | Value |
|---|---|
| No additional information available for this Dataset. | |
| Data-Source Molecule ID | Data-Source |
|---|---|
| 29155428 | surechembl |
| 30683800 | surechembl |
| 10658659 | pubchem |
| Molport-006-319-202 | molport |
| The data in this table is sourced from UniChem at EBI. | |