Dataset
1H nuclear magnetic resonance spectroscopy (1H NMR)
Chemical Info
InChI | InChI=1S/C19H20O/c1-2-19(20)18-13-16-8-7-14-3-5-15(6-4-14)9-11-17(18)12-10-16/h3-6,10,12-13H,2,7-9,11H2,1H3 |
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SMILES | CCC(=O)c1cc2CCc3ccc(CCc1cc2)cc3 |
InChI Key | GHIMYMOKWDVIQA-UHFFFAOYSA-N |
Molecular Formula | C19H20O |
Exact Mass | 264.362 g/mol |
Data and Resources
Metadata Information
Field | Value |
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DOI | 10.14272/GHIMYMOKWDVIQA-UHFFFAOYSA-N/CHMO0000593 |
License URL | |
Source | https://www.chemotion-repository.net/inchikey/GHIMYMOKWDVIQA-UHFFFAOYSA-N/CHMO0000593 |
Version | |
Author | Christoph Zippel |
Maintainer | Chemotion Repository |
Language | english |
MetadataCreated | 2024-09-07T04:34:21.984730 |
MetadataModified | 2024-09-07T19:48:38.486890 |
MetadataPublished | 2021-05-25 |
Related Molecule |
Field | Value |
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Measurement Technique | 1H nuclear magnetic resonance spectroscopy |
Measurement Variables |
Data-Source Molecule ID | Data-Source |
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155919820 | PubChem |
The data in this table is sourced from UniChem at EBI. |