Dataset
1H--1H correlation spectroscopy (1H-1H COSY)
Chemical Information
| InChI | InChI=1S/C6H13NO2.ClH/c1-6(2,3)9-5(8)4-7;/h4,7H2,1-3H3;1H |
|---|---|
| SMILES | NCC(=O)OC(C)(C)C.Cl |
| InChI Key | OSWULUXZFOQIRU-UHFFFAOYSA-N |
| Molecular Formula | C6H14ClNO2 |
| Exact Mass | 167.634 g/mol |
Data and Resources
Metadata Information
| Field | Value |
|---|---|
| DOI | 10.14272/OSWULUXZFOQIRU-UHFFFAOYSA-N/CHMO0001150 |
| License URL | |
| Source | https://www.chemotion-repository.net/inchikey/OSWULUXZFOQIRU-UHFFFAOYSA-N/CHMO0001150 |
| Version | |
| Author | Alex Johnson |
| Maintainer | Chemotion Repository |
| Language | english |
| MetadataPublished | 2024-08-07 |
| Related Molecule |
|
| Field | Value |
|---|---|
| Measurement Technique | 1H–1H correlation spectroscopy |
| Measurement Variables |
| Data-Source Molecule ID | Data-Source |
|---|---|
| 14659623 | surechembl |
| 336665 | surechembl |
| 11095016 | pubchem |
| 173500445 | pubchem |
| 2725036 | pubchem |
| PD196058 | probes_and_drugs |
| Molport-002-041-728 | molport |
| Molport-021-874-985 | molport |
| The data in this table is sourced from UniChem at EBI. | |