Dataset
13C nuclear magnetic resonance spectroscopy (13C NMR)
Chemical Info
InChI | InChI=1S/C24H30N2O3S/c1-5-28-22(27)11-8-14-26-21-10-7-6-9-20(21)25-24(26)30-16-15-29-23-18(3)13-12-17(2)19(23)4/h6-7,9-10,12-13H,5,8,11,14-16H2,1-4H3 |
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SMILES | CCOC(=O)CCCn1c(SCCOc2c(C)ccc(c2C)C)nc2c1cccc2 |
InChI Key | HNNQHZNNPICVSF-UHFFFAOYSA-N |
Molecular Formula | C24H30N2O3S |
Exact Mass | 426.572 g/mol |
Data and Resources
Metadata Information
Field | Value |
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DOI | 10.14272/HNNQHZNNPICVSF-UHFFFAOYSA-N/NMR/13C/CDCl3/75.1 |
License URL | |
Source | https://www.chemotion-repository.net/inchikey/HNNQHZNNPICVSF-UHFFFAOYSA-N/NMR/13C/CDCl3/75.1 |
Version | |
Author | Steven Susanto |
Maintainer | Chemotion Repository |
Language | english |
MetadataCreated | 2024-09-06T22:18:23.842601 |
MetadataModified | 2024-09-07T14:10:57.477725 |
MetadataPublished | 2015-10-31 |
Field | Value |
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Measurement Technique | 13C nuclear magnetic resonance spectroscopy |
Measurement Variables |
Data-Source Molecule ID | Data-Source |
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92042809 | PubChem |
The data in this table is sourced from UniChem at EBI. |