13C nuclear magnetic resonance spectroscopy (13C NMR)
URL: https://www.chemotion-repository.net/inchikey/AGYPLZHKXMPAFZ-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/C70H43N7O/c71-43-54-65(74-55-35-15-7-27-46(55)47-28-8-16-36-56(47)74)64(70-73-72-69(78-70)63(44-23-3-1-4-24-44)45-25-5-2-6-26-45)67(76-59-39-19-11-31-50(59)51-32-12-20-40-60(51)76)68(77-61-41-21-13-33-52(61)53-34-14-22-42-62(53)77)66(54)75-57-37-17-9-29-48(57)49-30-10-18-38-58(49)75/h1-42,63H |
|---|---|
| SMILES | N#Cc1c(n2c3ccccc3c3c2cccc3)c(c2nnc(o2)C(c2ccccc2)c2ccccc2)c(c(c1n1c2ccccc2c2c1cccc2)n1c2ccccc2c2c1cccc2)n1c2ccccc2c2c1cccc2 |
| InChI Key | AGYPLZHKXMPAFZ-UHFFFAOYSA-N |
| Molecular Formula | C70H43N7O |
| Exact Mass | 998.137 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 | 78efc84c-2230-4aba-8cfc-ffe81b80f0c3 |
| Package id | 10-14272-agyplzhkxmpafz-uhfffaoysa-n-chmo0000595 |
| Resource type | HTML |
| State | active |