Dataset
distortionless enhancement with polarization transfer (DEPT)
Chemical Info
InChI | InChI=1S/C18H20Cl3NO6/c1-2-8-25-16-12(22-17(24)18(19,20)21)13(23)14-11(27-16)9-26-15(28-14)10-6-4-3-5-7-10/h2-7,11-16,23H,1,8-9H2,(H,22,24)/t11-,12-,13-,14-,15?,16-/m1/s1 |
---|---|
SMILES | C=CCO[C@@H]1O[C@@H]2COC(O[C@H]2[C@@H]([C@H]1NC(=O)C(Cl)(Cl)Cl)O)c1ccccc1 |
InChI Key | ZXGTWIJUHZGJCL-ANNNQLRWSA-N |
Molecular Formula | C18H20Cl3NO6 |
Exact Mass | 452.713 g/mol |
Data and Resources
Metadata Information
Field | Value |
---|---|
DOI | 10.14272/ZXGTWIJUHZGJCL-ANNNQLRWSA-N/DEPT/90 |
License URL | |
Source | https://www.chemotion-repository.net/inchikey/ZXGTWIJUHZGJCL-ANNNQLRWSA-N/DEPT/90 |
Version | |
Author | Benjamin Goerling |
Maintainer | Chemotion Repository |
Language | english |
MetadataCreated | 2024-09-06T23:53:18.039140 |
MetadataModified | 2024-09-07T13:15:59.399547 |
MetadataPublished | 2014-05-27 |
Field | Value |
---|---|
Measurement Technique | distortionless enhancement with polarization transfer |
Measurement Variables |
Data-Source Molecule ID | Data-Source |
---|---|
73427311 | PubChem |
The data in this table is sourced from UniChem at EBI. |