1H nuclear magnetic resonance spectroscopy (1H NMR)
URL: https://www.chemotion-repository.net/inchikey/SMZPBAWVGNNTTI-DYTLHSPYSA-N/NMR/1H/CDCl3/400
Dataset description:
dataset for 1H nuclear magnetic resonance spectroscopy (1H NMR)\n\n
Chemical Info
InChI | InChI=1S/C23H26Cl3NO8/c1-3-11-31-21-17(27-22(30)23(24,25)26)19(34-16(29)10-9-13(2)28)18-15(33-21)12-32-20(35-18)14-7-5-4-6-8-14/h3-8,15,17-21H,1,9-12H2,2H3,(H,27,30)/t15-,17-,18-,19-,20?,21-/m1/s1 |
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SMILES | C=CCO[C@@H]1O[C@@H]2COC(O[C@H]2[C@@H]([C@H]1NC(=O)C(Cl)(Cl)Cl)OC(=O)CCC(=O)C)c1ccccc1 |
InChI Key | SMZPBAWVGNNTTI-DYTLHSPYSA-N |
Molecular Formula | C23H26Cl3NO8 |
Exact Mass | 550.813 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 | ee2bf95c-111f-496f-9c5b-cc8d379eedee |
Package id | 10-14272-smzpbawvgnntti-dytlhspysa-n-nmr-1h-cdcl3-400 |
Resource type | HTML |
State | active |