1H nuclear magnetic resonance spectroscopy (1H NMR)
URL: https://www.chemotion-repository.net/inchikey/ACAWWMOQOYSROM-SZXTZKNNSA-N/CHMO0000593
Dataset description:
dataset for 1H nuclear magnetic resonance spectroscopy (1H NMR)\n\n
Chemical Info
| InChI | InChI=1S/C58H42N4O8/c1-5-69-57(65)41-21-17-37(18-22-41)53-49-31-27-45(59-49)43(25-11-35-7-13-39(14-8-35)55(63)67-3)47-29-33-51(61-47)54(38-19-23-42(24-20-38)58(66)70-6-2)52-34-30-48(62-52)44(46-28-32-50(53)60-46)26-12-36-9-15-40(16-10-36)56(64)68-4/h7-10,13-24,27-34,59,62H,5-6H2,1-4H3/b45-43-,46-44-,47-43-,48-44-,53-49-,53-50-,54-51-,54-52- |
|---|---|
| SMILES | CCOC(=O)c1ccc(cc1)/C/1=C/2\C=CC(=N2)/C(=c\2/cc/c(=C(/C3=N/C(=C(\c4[nH]c1cc4)/C#Cc1ccc(cc1)C(=O)OC)/C=C3)\c1ccc(cc1)C(=O)OCC)/[nH]2)/C#Cc1ccc(cc1)C(=O)OC |
| InChI Key | ACAWWMOQOYSROM-SZXTZKNNSA-N |
| Molecular Formula | C58H42N4O8 |
| Exact Mass | 922.976 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 | a4a0a68a-fd1d-4215-9b0f-81e4cf49101a |
| Package id | 10-14272-acawwmoqoysrom-szxtzknnsa-n-chmo0000593 |
| Resource type | HTML |
| State | active |