Dataset
distortionless enhancement with polarization transfer (DEPT)
Chemical Info
InChI | InChI=1S/C14H11NOS/c1-9-2-7-12-13(8-9)17-14(15-12)10-3-5-11(16)6-4-10/h2-8,16H,1H3 |
---|---|
SMILES | Oc1ccc(cc1)c1nc2c(s1)cc(cc2)C |
InChI Key | YRPIXORGESANFA-UHFFFAOYSA-N |
Molecular Formula | C14H11NOS |
Exact Mass | 241.308 g/mol |
Data and Resources
Metadata Information
Field | Value |
---|---|
DOI | 10.14272/YRPIXORGESANFA-UHFFFAOYSA-N/CHMO0000596.9 |
License URL | |
Source | https://www.chemotion-repository.net/inchikey/YRPIXORGESANFA-UHFFFAOYSA-N/CHMO0000596.9 |
Version | |
Author | Patrick Hodapp |
Maintainer | Chemotion Repository |
Language | english |
MetadataCreated | 2024-09-07T02:42:54.581871 |
MetadataModified | 2024-09-07T17:21:07.854578 |
MetadataPublished | 2020-03-11 |
Field | Value |
---|---|
Measurement Technique | distortionless enhancement with polarization transfer |
Measurement Variables |
Data-Source Molecule ID | Data-Source |
---|---|
ZINC000000157514 | ZINC |
348697 | PubChem |
SCHEMBL2244143 | SureChEMBL |
1397703 | eMolecules |
7621-87-6 | ACToR |
MCULE-4466281146 | Mcule |
The data in this table is sourced from UniChem at EBI. |