1H nuclear magnetic resonance spectroscopy (1H NMR)
URL: https://www.chemotion-repository.net/inchikey/LCHRVGBGMUEFLV-VPHDGDOJSA-N/CHMO0000593
Dataset description:
dataset for 1H nuclear magnetic resonance spectroscopy (1H NMR)\n\n
Chemical Info
| InChI | InChI=1S/C65H54N6O6/c1-4-5-6-7-8-17-36-77-63-57(66-52-22-15-16-23-53(52)71-63)35-34-55-54(67-58-37-48(42-18-11-9-12-19-42)49(38-59(58)68-55)43-20-13-10-14-21-43)32-33-56-62(41-72)70-61-40-51(45-26-30-47(31-27-45)65(74)76-3)50(39-60(61)69-56)44-24-28-46(29-25-44)64(73)75-2/h9-16,18-35,37-41H,4-8,17,36H2,1-3H3/b33-32+,35-34+ |
|---|---|
| SMILES | CCCCCCCCOc1nc2ccccc2nc1/C=C/c1nc2cc(c3ccccc3)c(cc2nc1/C=C/c1nc2cc(c3ccc(cc3)C(=O)OC)c(cc2nc1C=O)c1ccc(cc1)C(=O)OC)c1ccccc1 |
| InChI Key | LCHRVGBGMUEFLV-VPHDGDOJSA-N |
| Molecular Formula | C65H54N6O6 |
| Exact Mass | 1015.161 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 | c5d21f74-02dc-4280-b68a-e305672b9e43 |
| Package id | 10-14272-lchrvgbgmueflv-vphdgdojsa-n-chmo0000593 |
| Resource type | HTML |
| State | active |