13C nuclear magnetic resonance spectroscopy (13C NMR)
URL: https://www.chemotion-repository.net/inchikey/BPVDJXUNJWJXMH-ANDZSCLQSA-N/NMR/13C/CDCl3/100
Dataset description:
dataset for 13C nuclear magnetic resonance spectroscopy (13C NMR)\n\n
Source: 13C nuclear magnetic resonance spectroscopy (13C NMR)
Chemical Info
InChI | InChI=1S/C22H27NO10/c1-12(24)29-11-18-20(30-13(2)25)21(31-14(3)26)19(22(33-18)32-15(4)27)23-10-16-6-8-17(28-5)9-7-16/h6-10,18-22H,11H2,1-5H3/b23-10+/t18-,19-,20-,21-,22?/m1/s1 |
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SMILES | COc1ccc(cc1)/C=N/[C@H]1C(OC(=O)C)O[C@@H]([C@H]([C@@H]1OC(=O)C)OC(=O)C)COC(=O)C |
InChI Key | BPVDJXUNJWJXMH-ANDZSCLQSA-N |
Molecular Formula | C22H27NO10 |
Exact Mass | 465.450 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 | 3fb935f8-1204-42e2-a117-bd917fe1f3d2 |
Package id | 10-14272-bpvdjxunjwjxmh-andzsclqsa-n-nmr-13c-cdcl3-100 |
Resource type | HTML |
State | active |