Dataset
distortionless enhancement with polarization transfer (DEPT)
Chemical Info
InChI | InChI=1S/C7H8IN/c1-9-7-5-3-2-4-6(7)8/h2-5,9H,1H3 |
---|---|
SMILES | CNc1ccccc1I |
InChI Key | WSLMOORTNOTZCO-UHFFFAOYSA-N |
Molecular Formula | C7H8IN |
Exact Mass | 233.050 g/mol |
Data and Resources
Metadata Information
Field | Value |
---|---|
DOI | 10.14272/WSLMOORTNOTZCO-UHFFFAOYSA-N/CHMO0000596.1 |
License URL | |
Source | https://www.chemotion-repository.net/inchikey/WSLMOORTNOTZCO-UHFFFAOYSA-N/CHMO0000596.1 |
Version | |
Author | Helena Šimek |
Maintainer | Chemotion Repository |
Language | english |
MetadataCreated | 2024-09-07T03:19:25.708405 |
MetadataModified | 2024-09-07T18:10:39.173409 |
MetadataPublished | 2020-06-11 |
Field | Value |
---|---|
Measurement Technique | distortionless enhancement with polarization transfer |
Measurement Variables |
Data-Source Molecule ID | Data-Source |
---|---|
36766110 | eMolecules |
11031766 | PubChem |
16095513 | PubChem: Thomson Pharma |
SCHEMBL6401 | SureChEMBL |
J702.903I | Nikkaji |
ZINC000020359023 | ZINC |
DTXSID10452652 | EPA CompTox Dashboard |
MCULE-9418514371 | Mcule |
The data in this table is sourced from UniChem at EBI. |