Dataset
distortionless enhancement with polarization transfer (DEPT)
Chemical Info
InChI | InChI=1S/C16H20Cl3NO10/c1-6(21)26-5-10-12(27-7(2)22)13(28-8(3)23)11(14(30-10)29-9(4)24)20-15(25)16(17,18)19/h10-14H,5H2,1-4H3,(H,20,25)/t10-,11-,12-,13-,14?/m1/s1 |
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SMILES | CC(=O)OC[C@H]1OC(OC(=O)C)[C@@H]([C@H]([C@@H]1OC(=O)C)OC(=O)C)NC(=O)C(Cl)(Cl)Cl |
InChI Key | SEEYXQVYXYGHNF-GNMOMJPPSA-N |
Molecular Formula | C16H20Cl3NO10 |
Exact Mass | 492.690 g/mol |
Data and Resources
Metadata Information
Field | Value |
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DOI | 10.14272/SEEYXQVYXYGHNF-GNMOMJPPSA-N/DEPT/90 |
License URL | |
Source | https://www.chemotion-repository.net/inchikey/SEEYXQVYXYGHNF-GNMOMJPPSA-N/DEPT/90 |
Version | |
Author | Benjamin Goerling |
Maintainer | Chemotion Repository |
Language | english |
MetadataCreated | 2024-09-06T22:44:17.221802 |
MetadataModified | 2024-09-07T12:10:28.057810 |
MetadataPublished | 2014-05-27 |
Field | Value |
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Measurement Technique | distortionless enhancement with polarization transfer |
Measurement Variables |
Data-Source Molecule ID | Data-Source |
---|---|
SCHEMBL5332270 | SureChEMBL |
69409414 | PubChem |
J2.776.497E | Nikkaji |
The data in this table is sourced from UniChem at EBI. |