Molecule
attenuated total reflectance Fourier transform infrared spectroscopy (ATR-FTIR)
high-resolution electrospray ionisation time-of-flight mass spectrometry (HR-ESI-TOF-MS)
copper;2-(2-cyclohexylquinolin-8-yl)-1,1,3,3-tetramethylguanidine;trifluoromethanesulfonate
Chemical Information
| InChI | InChI=1S/2C20H28N4.2CHF3O3S.Cu/c2*1-23(2)20(24(3)4)22-18-12-8-11-16-13-14-17(21-19(16)18)15-9-6-5-7-10-15;2*2-1(3,4)8(5,6)7;/h2*8,11-15H,5-7,9-10H2,1-4H3;2*(H,5,6,7);/q;;;;+2/p-2 |
|---|---|
| SMILES | FC(S(=O)(=O)[O-])(F)F.FC(S(=O)(=O)[O-])(F)F.CN(C(=Nc1cccc2c1nc(cc2)C1CCCCC1)N(C)C)C.CN(C(=Nc1cccc2c1nc(cc2)C1CCCCC1)N(C)C)C.[Cu+2] |
| InChI Key | XYXSWFSTLISVKT-UHFFFAOYSA-L |
| Exact Mass | 1010.610 g/mol |
2 Related Dataset(s)
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Metadata Information
| Field | Value |
|---|---|
| NFDI4Chem Molecule ID | nfdi4chem-mol2617 |
| Source | |
| Alternate Name |
| Field | Value |
|---|---|
| No additional information available for this Dataset. | |
| Data-Source Molecule ID | Data-Source |
|---|---|
| 162677542 | pubchem |
| The data in this table is sourced from UniChem at EBI. | |