infrared absorption spectroscopy (IR)
URL: https://www.chemotion-repository.net/inchikey/KDRGHQUXYJMOLQ-UHFFFAOYSA-N/IR
Dataset description:
dataset for infrared absorption spectroscopy (IR)\n\n
Chemical Info
InChI | InChI=1S/C16H12F3N3O/c17-16(18,19)12-8-4-7-11-14(12)21-22-15(11)20-13(23)9-10-5-2-1-3-6-10/h1-8H,9H2,(H2,20,21,22,23) |
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SMILES | O=C(Nc1n[nH]c2c1cccc2C(F)(F)F)Cc1ccccc1 |
InChI Key | KDRGHQUXYJMOLQ-UHFFFAOYSA-N |
Molecular Formula | C16H12F3N3O |
Exact Mass | 319.281 g/mol |
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Additional Information
Field | Value |
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Data last updated | September 7, 2024 |
Metadata last updated | September 7, 2024 |
Created | September 7, 2024 |
Format | HTML |
License | No License Provided |
Id | eaba7234-1553-45bf-8980-2796657338a5 |
Package id | 10-14272-kdrghquxyjmolq-uhfffaoysa-n-ir |
Resource type | HTML |
State | active |