Dataset
proton-decoupled 31P nuclear magnetic resonance spectroscopy (31P{1H}-NMR)
Chemical Info
InChI | InChI=1S/C22H29N5O2.C2H3N.Cu.F6P/c1-21(2,3)17-11-13-26(24-17)19(27-14-12-18(25-27)22(4,5)6)15-9-8-10-16(23-15)20(28)29-7;1-2-3;;1-7(2,3,4,5)6/h8-14,19H,1-7H3;1H3;;/q;;+1;-1 |
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SMILES | F[P-](F)(F)(F)(F)F.COC(=O)c1cccc(n1)C(n1ccc(n1)C(C)(C)C)n1ccc(n1)C(C)(C)C.CC#N.[Cu+] |
InChI Key | UQZCBWVOIVXJNI-UHFFFAOYSA-N |
Molecular Formula | C24H32CuF6N6O2P |
Exact Mass | 645.060 g/mol |
Data and Resources
Metadata Information
Field | Value |
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DOI | 10.14272/UQZCBWVOIVXJNI-UHFFFAOYSA-N/CHMO0000889 |
License URL | |
Source | https://www.chemotion-repository.net/inchikey/UQZCBWVOIVXJNI-UHFFFAOYSA-N/CHMO0000889 |
Version | |
Author | Sonja Herres-Pawlis |
Maintainer | Chemotion Repository |
Language | english |
MetadataCreated | 2024-09-07T05:11:52.239850 |
MetadataModified | 2024-09-07T20:36:43.771932 |
MetadataPublished | 2021-10-16 |
Field | Value |
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Measurement Technique | proton-decoupled 31P nuclear magnetic resonance spectroscopy |
Measurement Variables |
Data-Source Molecule ID | Data-Source |
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156619349 | PubChem |
The data in this table is sourced from UniChem at EBI. |