Dataset
distortionless enhancement with polarization transfer (DEPT)
Chemical Info
InChI | InChI=1S/C18H20S2/c1-14-4-8-16(9-5-14)18(19-12-3-13-20-18)17-10-6-15(2)7-11-17/h4-11H,3,12-13H2,1-2H3 |
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SMILES | Cc1ccc(cc1)C1(SCCCS1)c1ccc(cc1)C |
InChI Key | HXQGJLZXQGNWMG-UHFFFAOYSA-N |
Molecular Formula | C18H20S2 |
Exact Mass | 300.481 g/mol |
Data and Resources
Metadata Information
Field | Value |
---|---|
DOI | 10.14272/HXQGJLZXQGNWMG-UHFFFAOYSA-N/DEPT/135 |
License URL | |
Source | https://www.chemotion-repository.net/inchikey/HXQGJLZXQGNWMG-UHFFFAOYSA-N/DEPT/135 |
Version | |
Author | Nicole Jung |
Maintainer | Chemotion Repository |
Language | english |
MetadataCreated | 2024-09-06T23:49:19.164712 |
MetadataModified | 2024-09-07T13:10:05.998263 |
MetadataPublished | 2014-05-27 |
Field | Value |
---|---|
Measurement Technique | distortionless enhancement with polarization transfer |
Measurement Variables |
Data-Source Molecule ID | Data-Source |
---|---|
15915187 | PubChem: Thomson Pharma |
10870320 | PubChem |
DTXSID30446593 | EPA CompTox Dashboard |
J633.266H | Nikkaji |
The data in this table is sourced from UniChem at EBI. |