infrared absorption spectroscopy (IR)
URL: https://www.chemotion-repository.net/inchikey/WDIFERGUPSXYRV-DYTPTGLASA-N/IR
Dataset description:
dataset for infrared absorption spectroscopy (IR)\n\n
Chemical Info
| InChI | InChI=1S/C39H46ClFN2O8/c1-7-33(44)42-30(38(47)49-5)19-28(34(42)23-9-13-25(40)14-10-23)36(45)43-31(39(48)50-6)20-29(35(43)24-11-15-26(41)16-12-24)37(46)51-32-18-22(4)8-17-27(32)21(2)3/h7,9-16,21-22,27-32,34-35H,1,8,17-20H2,2-6H3/t22-,27+,28-,29+,30-,31+,32-,34-,35+/m1/s1 |
|---|---|
| SMILES | COC(=O)[C@@H]1C[C@@H]([C@@H](N1C(=O)[C@@H]1C[C@@H](N([C@@H]1c1ccc(cc1)Cl)C(=O)C=C)C(=O)OC)c1ccc(cc1)F)C(=O)O[C@@H]1C[C@H](C)CC[C@H]1C(C)C |
| InChI Key | WDIFERGUPSXYRV-DYTPTGLASA-N |
| Molecular Formula | C39H46ClFN2O8 |
| Exact Mass | 725.243 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 | 17a5d8e5-8b44-43cf-a89e-3e27cac4c1a9 |
| Package id | 10-14272-wdifergupsxyrv-dytptglasa-n-ir |
| Resource type | HTML |
| State | active |