Dataset
distortionless enhancement with polarization transfer (DEPT)
Chemical Info
InChI | InChI=1S/C20H24Cl3NO7/c1-3-9-29-18-15(24-19(27)20(21,22)23)16(26)17(30-12(2)25)14(31-18)11-28-10-13-7-5-4-6-8-13/h3-8,14-18,26H,1,9-11H2,2H3,(H,24,27)/t14-,15-,16-,17-,18-/m1/s1 |
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SMILES | C=CCO[C@@H]1O[C@H](COCc2ccccc2)[C@H]([C@@H]([C@H]1NC(=O)C(Cl)(Cl)Cl)O)OC(=O)C |
InChI Key | CPWPYKROAWGMGK-DUQPFJRNSA-N |
Molecular Formula | C20H24Cl3NO7 |
Exact Mass | 496.766 g/mol |
Data and Resources
Metadata Information
Field | Value |
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DOI | 10.14272/CPWPYKROAWGMGK-DUQPFJRNSA-N/DEPT/90 |
License URL | |
Source | https://www.chemotion-repository.net/inchikey/CPWPYKROAWGMGK-DUQPFJRNSA-N/DEPT/90 |
Version | |
Author | Benjamin Goerling |
Maintainer | Chemotion Repository |
Language | english |
MetadataCreated | 2024-09-06T22:49:48.031551 |
MetadataModified | 2024-09-07T12:27:53.559930 |
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 |
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73427406 | PubChem |
J2.082.268F | Nikkaji |
The data in this table is sourced from UniChem at EBI. |