infrared absorption spectroscopy (IR)
URL: https://www.chemotion-repository.net/inchikey/WTSCPKRWCDILIV-GOSISDBHSA-N/IR
Dataset description:
dataset for infrared absorption spectroscopy (IR)\n\n
Chemical Info
InChI | InChI=1S/C21H17F3N2O9S/c1-33-20(28)18-10-15(35-36(31,32)21(22,23)24)11-25(18)19(27)16-9-14(7-8-17(16)26(29)30)34-12-13-5-3-2-4-6-13/h2-9,11,18H,10,12H2,1H3/t18-/m1/s1 |
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SMILES | COC(=O)[C@H]1CC(=CN1C(=O)c1cc(ccc1[N+](=O)[O-])OCc1ccccc1)OS(=O)(=O)C(F)(F)F |
InChI Key | WTSCPKRWCDILIV-GOSISDBHSA-N |
Molecular Formula | C21H17F3N2O9S |
Exact Mass | 530.428 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 | fd58f20b-7365-4a17-8e66-798212d4b9a4 |
Package id | 10-14272-wtscpkrwcdiliv-gosisdbhsa-n-ir |
Resource type | HTML |
State | active |