Dataset
high-resolution electrospray ionisation mass spectrometry (HRESIMS)
Chemical Info
InChI | InChI=1S/C18H18O6.6CO.2Co/c1-22-10-4-5-13-15-11-12(17(20)23-2)7-8-14(15)18(21)24-16(13)6-3-9-19;6*1-2;;/h7-8,11,19H,3,6,9-10H2,1-2H3;;;;;;;; |
---|---|
SMILES | OCCCc1oc(=O)c2c(c1C13[Co]4([Co]1(C34COC)(C#[O])(C#[O])C#[O])(C#[O])(C#[O])C#[O])cc(cc2)C(=O)OC |
InChI Key | NAVZHPYOUBONBC-UHFFFAOYSA-N |
Molecular Formula | C24H18Co2O12 |
Exact Mass | 616.259 g/mol |
Data and Resources
Metadata Information
Field | Value |
---|---|
DOI | 10.14272/NAVZHPYOUBONBC-UHFFFAOYSA-N/CHMO0000485 |
License URL | |
Source | https://www.chemotion-repository.net/inchikey/NAVZHPYOUBONBC-UHFFFAOYSA-N/CHMO0000485 |
Version | |
Author | Irina Balova |
Maintainer | Chemotion Repository |
Language | english |
MetadataCreated | 2024-09-07T08:25:20.964116 |
MetadataModified | 2024-09-08T00:25:11.636906 |
MetadataPublished | 2023-02-16 |
Field | Value |
---|---|
Measurement Technique | high-resolution electrospray ionisation mass spectrometry |
Measurement Variables |
Data-Source Molecule ID | Data-Source |
---|---|
No additional information available for this Dataset. |