infrared absorption spectroscopy (IR)
URL: https://www.chemotion-repository.net/inchikey/VMBNKDPNTRHCJF-UHFFFAOYSA-N/IR
Dataset description:
dataset for infrared absorption spectroscopy (IR)\n\n
Chemical Info
| InChI | InChI=1S/C64H39N7O/c1-39-34-36-40(37-35-39)63-66-67-64(72-63)58-59(68-50-26-10-2-18-41(50)42-19-3-11-27-51(42)68)49(38-65)60(69-52-28-12-4-20-43(52)44-21-5-13-29-53(44)69)62(71-56-32-16-8-24-47(56)48-25-9-17-33-57(48)71)61(58)70-54-30-14-6-22-45(54)46-23-7-15-31-55(46)70/h2-37H,1H3 |
|---|---|
| SMILES | N#Cc1c(n2c3ccccc3c3c2cccc3)c(c2nnc(o2)c2ccc(cc2)C)c(c(c1n1c2ccccc2c2c1cccc2)n1c2ccccc2c2c1cccc2)n1c2ccccc2c2c1cccc2 |
| InChI Key | VMBNKDPNTRHCJF-UHFFFAOYSA-N |
| Molecular Formula | C64H39N7O |
| Exact Mass | 922.041 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 | eaedb376-08be-4658-9cdf-b78f5b710557 |
| Package id | 10-14272-vmbnkdpntrhcjf-uhfffaoysa-n-ir |
| Resource type | HTML |
| State | active |