Dataset
13C nuclear magnetic resonance spectroscopy (13C NMR)
Chemical Info
InChI | InChI=1S/C23H25N2O4.ClH/c1-14-9-18(22(26)28-5)10-15(2)20(14)24-7-8-25(13-24)21-16(3)11-19(12-17(21)4)23(27)29-6;/h7-13H,1-6H3;1H/q+1;/p-1 |
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SMILES | COC(=O)c1cc(C)c(c(c1)C)n1cc[n+](c1)c1c(C)cc(cc1C)C(=O)OC.[Cl-] |
InChI Key | DRBWVNNAFWIKLM-UHFFFAOYSA-M |
Molecular Formula | C23H25ClN2O4 |
Exact Mass | 428.909 g/mol |
Data and Resources
Metadata Information
Field | Value |
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DOI | 10.14272/DRBWVNNAFWIKLM-UHFFFAOYSA-M/CHMO0000595 |
License URL | |
Source | https://www.chemotion-repository.net/inchikey/DRBWVNNAFWIKLM-UHFFFAOYSA-M/CHMO0000595 |
Version | |
Author | Simon Oßwald |
Maintainer | Chemotion Repository |
Language | english |
MetadataCreated | 2024-09-07T02:49:23.720081 |
MetadataModified | 2024-09-07T17:29:53.255268 |
MetadataPublished | 2020-04-08 |
Field | Value |
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Measurement Technique | 13C nuclear magnetic resonance spectroscopy |
Measurement Variables |