Dataset
Caripyrin.dept
Chemical Info
InChI | InChI=1S/C10H11NO3/c1-6-9(14-6)7-3-4-8(11-5-7)10(12)13-2/h3-6,9H,1-2H3/t6-,9+/m0/s1 |
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SMILES | COC(=O)C1=NC=C([C@@H]2O[C@H]2C)C=C1 |
InChI Key | DLDOQXDHLFJKLM-IMTBSYHQSA-N |
Molecular Formula | C10H11NO3 |
Exact Mass | 193.200 g/mol |
Data and Resources
Metadata Information
Field | Value |
---|---|
DOI | 10.57992/nmrxiv.p14.s81.d481 |
License URL | https://creativecommons.org/licenses/by-sa/4.0/legalcode |
Source | https://nmrxiv.org/D481 |
Version | |
Author | Rieger PH, Liermann JC, Opatz T, Anke H, Thines E. |
Maintainer | |
Language | english |
MetadataCreated | 2024-04-22T15:32:17.480946 |
MetadataModified | 2024-09-23T09:27:54.762152 |
MetadataPublished | 2022-11-10 17:46:02 |
Field | Value |
---|---|
Measurement Technique | distortionless enhancement with polarization transfer |
Measurement Variables |
|
Data-Source Molecule ID | Data-Source |
---|---|
50936726 | PubChem |
J2.864.283K | Nikkaji |
20204179 | NMRShiftDB |
The data in this table is sourced from UniChem at EBI. |