1H nuclear magnetic resonance spectroscopy (1H NMR)
URL: https://www.chemotion-repository.net/inchikey/LGSDFUJUBGCHIW-UHFFFAOYSA-L/CHMO0000593
Dataset description:
dataset for 1H nuclear magnetic resonance spectroscopy (1H NMR)\n\n
Chemical Info
| InChI | InChI=1S/2C14H22N4.2CHF3O3S.Zn/c2*1-17(2)14(18(3)4)16-12-9-5-7-11-8-6-10-15-13(11)12;2*2-1(3,4)8(5,6)7;/h2*6,8,10,12H,5,7,9H2,1-4H3;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(=NC1CCCc2c1nccc2)N(C)C)C.CN(C(=NC1CCCc2c1nccc2)N(C)C)C.[Zn+2] |
| InChI Key | LGSDFUJUBGCHIW-UHFFFAOYSA-L |
| Molecular Formula | C30H44F6N8O6S2Zn |
| Exact Mass | 856.221 g/mol |
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Additional Information
| Field | Value |
|---|---|
| Data last updated | September 8, 2024 |
| Metadata last updated | September 8, 2024 |
| Created | September 8, 2024 |
| Format | HTML |
| License | No License Provided |
| Id | 62b97334-cdd1-48ab-9239-74c43ff0dcf5 |
| Package id | 10-14272-lgsdfujubgchiw-uhfffaoysa-l-chmo0000593 |
| Resource type | HTML |
| State | active |