mass spectrometry (MS)
URL: https://www.chemotion-repository.net/inchikey/OOXACMCOHFJPIU-PWNOKTKGSA-N/CHMO0000470
Chemical Info
| InChI | InChI=1S/C88H54N8.2Fe.O/c1-8-24-55(25-9-1)80-65-41-44-69(90-65)83(58-30-14-4-15-31-58)73-49-52-77(94-73)87(78-53-50-74(95-78)84(59-32-16-5-17-33-59)70-45-42-66(80)91-70)63-39-23-22-38-62(63)64-54-79-85(60-34-18-6-19-35-60)75-47-46-71(92-75)81(56-26-10-2-11-27-56)67-40-43-68(89-67)82(57-28-12-3-13-29-57)72-48-51-76(93-72)86(88(64)96-79)61-36-20-7-21-37-61;;;/h1-54H;;;/q-4;2*+2;/b80-65-,80-66-,81-67-,81-71-,82-68-,82-72-,83-69-,83-73-,84-70-,84-74-,85-75-,85-79-,86-76-,87-77-,87-78-,88-86-;;; |
|---|---|
| SMILES | c1ccc(cc1)/C/1=C/2\C=CC(=N2)/C/2=c/3\n4[Fe](n5c1ccc5/C(=C\1/C=CC(=N1)/C(=c\4/cc3)/c1ccccc1)/c1ccccc1)O[Fe]1n3/c/4=C(/c5ccccc5)\C5=N/C(=C(\c6n1c(c(-c1c2cccc1)c6)/C(=C/1\N=C(/C(=c\3/cc4)/c2ccccc2)C=C1)/c1ccccc1)/c1ccccc1)/C=C5 |
| InChI Key | OOXACMCOHFJPIU-PWNOKTKGSA-N |
| Molecular Formula | C88H54Fe2N8O |
| Exact Mass | 1351.113 g/mol |
There are no views created for this resource yet.
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 | 7df1986b-19c4-4d2f-b376-3275a1319cc6 |
| Package id | 10-14272-ooxacmcohfjpiu-pwnoktkgsa-n-chmo0000470 |
| Resource type | HTML |
| State | active |