13C nuclear magnetic resonance spectroscopy (13C NMR)
URL: https://www.chemotion-repository.net/inchikey/HFHZJNWFQLVEGX-UHFFFAOYSA-N/CHMO0000595
Dataset description:
dataset for 13C nuclear magnetic resonance spectroscopy (13C NMR)\n\n
Source: 13C nuclear magnetic resonance spectroscopy (13C NMR)
Chemical Info
| InChI | InChI=1S/C59H35N7O/c1-2-53-61-62-59(67-53)54-55(63-45-27-11-3-19-36(45)37-20-4-12-28-46(37)63)44(35-60)56(64-47-29-13-5-21-38(47)39-22-6-14-30-48(39)64)58(66-51-33-17-9-25-42(51)43-26-10-18-34-52(43)66)57(54)65-49-31-15-7-23-40(49)41-24-8-16-32-50(41)65/h2-34H,1H2 |
|---|---|
| SMILES | C=Cc1nnc(o1)c1c(n2c3ccccc3c3c2cccc3)c(n2c3ccccc3c3c2cccc3)c(c(c1n1c2ccccc2c2c1cccc2)C#N)n1c2ccccc2c2c1cccc2 |
| InChI Key | HFHZJNWFQLVEGX-UHFFFAOYSA-N |
| Molecular Formula | C59H35N7O |
| Exact Mass | 857.956 g/mol |
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Additional Information
| Field | Value |
|---|---|
| Data last updated | September 7, 2024 |
| Metadata last updated | September 7, 2024 |
| Created | September 7, 2024 |
| Format | HTML |
| License | No License Provided |
| Id | bd94cca4-f55d-4e30-b4c1-e5fbb2a5878a |
| Package id | 10-14272-hfhzjnwfqlvegx-uhfffaoysa-n-chmo0000595 |
| Resource type | HTML |
| State | active |