Dataset
13C nuclear magnetic resonance spectroscopy (13C NMR)
Chemical Info
InChI | InChI=1S/C21H26O10/c1-12(22)26-11-17-18(28-13(2)23)19(27-10-16-8-6-5-7-9-16)20(29-14(3)24)21(31-17)30-15(4)25/h5-9,17-21H,10-11H2,1-4H3/t17-,18-,19+,20-,21?/m1/s1 |
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SMILES | CC(=O)OC[C@H]1OC(OC(=O)C)[C@@H]([C@H]([C@@H]1OC(=O)C)OCc1ccccc1)OC(=O)C |
InChI Key | SJPSXDYBIIGRQJ-AWGDKMGJSA-N |
Molecular Formula | C21H26O10 |
Exact Mass | 438.425 g/mol |
Data and Resources
Metadata Information
Field | Value |
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DOI | 10.14272/SJPSXDYBIIGRQJ-AWGDKMGJSA-N/NMR/13C/CDCl3/100 |
License URL | |
Source | https://www.chemotion-repository.net/inchikey/SJPSXDYBIIGRQJ-AWGDKMGJSA-N/NMR/13C/CDCl3/100 |
Version | |
Author | Benjamin Goerling |
Maintainer | Chemotion Repository |
Language | english |
MetadataCreated | 2024-09-06T22:32:19.833118 |
MetadataModified | 2024-09-07T11:51:00.033601 |
MetadataPublished | 2014-05-27 |
Field | Value |
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Measurement Technique | 13C nuclear magnetic resonance spectroscopy |
Measurement Variables |