1H nuclear magnetic resonance spectroscopy (1H NMR)
URL: https://www.chemotion-repository.net/inchikey/DBNVVGCBNDLOJC-ZHACJKMWSA-N/CHMO0000593
Dataset description:
dataset for 1H nuclear magnetic resonance spectroscopy (1H NMR)\n\n
Chemical Info
| InChI | InChI=1S/C31H19F17N4O2/c1-14-16(50-18-7-3-2-6-17(18)49-14)10-11-21-22(52-20-9-5-4-8-19(20)51-21)23-53-13-15(54-23)12-24(32,33)25(34,35)26(36,37)27(38,39)28(40,41)29(42,43)30(44,45)31(46,47)48/h2-11,15,23H,12-13H2,1H3/b11-10+ |
|---|---|
| SMILES | Cc1nc2ccccc2nc1/C=C/c1nc2ccccc2nc1C1OCC(O1)CC(C(C(C(C(C(C(C(F)(F)F)(F)F)(F)F)(F)F)(F)F)(F)F)(F)F)(F)F |
| InChI Key | DBNVVGCBNDLOJC-ZHACJKMWSA-N |
| Molecular Formula | C31H19F17N4O2 |
| Exact Mass | 802.481 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 | 766738c7-96b2-4beb-9cfc-6d041001784b |
| Package id | 10-14272-dbnvvgcbndlojc-zhacjkmwsa-n-chmo0000593 |
| Resource type | HTML |
| State | active |