1H nuclear magnetic resonance spectroscopy (1H NMR)
URL: https://www.chemotion-repository.net/inchikey/FIXDPECESSBSFY-UHFFFAOYSA-N/CHMO0000593
Dataset description:
dataset for 1H nuclear magnetic resonance spectroscopy (1H NMR)\n\n
Chemical Info
| InChI | InChI=1S/C31H20F15NO2/c1-18-7-9-20(10-8-18)17-47(23-6-4-3-5-21(23)14-11-19-12-15-22(49-2)16-13-19)24(48)25(32,33)26(34,35)27(36,37)28(38,39)29(40,41)30(42,43)31(44,45)46/h3-10,12-13,15-16H,17H2,1-2H3 |
|---|---|
| SMILES | COc1ccc(cc1)C#Cc1ccccc1N(C(=O)C(C(C(C(C(C(C(F)(F)F)(F)F)(F)F)(F)F)(F)F)(F)F)(F)F)Cc1ccc(cc1)C |
| InChI Key | FIXDPECESSBSFY-UHFFFAOYSA-N |
| Molecular Formula | C31H20F15NO2 |
| Exact Mass | 723.472 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 | 79091b34-811b-48f3-bbd1-d581f524d3fc |
| Package id | 10-14272-fixdpecessbsfy-uhfffaoysa-n-chmo0000593 |
| Resource type | HTML |
| State | active |