13C nuclear magnetic resonance spectroscopy (13C NMR)
URL: https://www.chemotion-repository.net/inchikey/DNIMTJFIIINLHD-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/C52H38N4O16/c1-5-69-49(57)27-9-13-31(43(21-27)53(61)62)39-25-40(32-14-10-28(50(58)70-6-2)22-44(32)54(63)64)36-19-20-38-42(34-16-12-30(52(60)72-8-4)24-46(34)56(67)68)26-41(37-18-17-35(39)47(36)48(37)38)33-15-11-29(51(59)71-7-3)23-45(33)55(65)66/h9-26H,5-8H2,1-4H3 |
|---|---|
| SMILES | CCOC(=O)c1ccc(c(c1)[N+](=O)[O-])c1cc(c2c3c1ccc1c3c(cc2)c(cc1c1ccc(cc1[N+](=O)[O-])C(=O)OCC)c1ccc(cc1[N+](=O)[O-])C(=O)OCC)c1ccc(cc1[N+](=O)[O-])C(=O)OCC |
| InChI Key | DNIMTJFIIINLHD-UHFFFAOYSA-N |
| Exact Mass | 974.875 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 | 11dd3bb8-58da-4141-a939-f53a7af8480e |
| Package id | 10-14272-dnimtjfiiinlhd-uhfffaoysa-n-chmo0000595 |
| Resource type | HTML |
| State | active |