Dataset
1H--13C heteronuclear single quantum coherence (1H-13C HSQC)
Chemical Info
InChI | InChI=1S/C14H19NO2/c1-11(2)15-7-6-12-4-5-13(10-14(12)15)17-9-8-16-3/h4-7,10-11H,8-9H2,1-3H3 |
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SMILES | COCCOc1ccc2c(c1)n(cc2)C(C)C |
InChI Key | ZVJFHSSZXWFKTI-UHFFFAOYSA-N |
Molecular Formula | C14H19NO2 |
Exact Mass | 233.306 g/mol |
Data and Resources
Metadata Information
Field | Value |
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DOI | 10.14272/ZVJFHSSZXWFKTI-UHFFFAOYSA-N/CHMO0001146 |
License URL | |
Source | https://www.chemotion-repository.net/inchikey/ZVJFHSSZXWFKTI-UHFFFAOYSA-N/CHMO0001146 |
Version | |
Author | Niklas Krappel |
Maintainer | Chemotion Repository |
Language | english |
MetadataCreated | 2024-09-08T01:12:43.896473 |
MetadataModified | 2024-09-08T01:12:43.896479 |
MetadataPublished | 2023-07-31 |
Field | Value |
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Measurement Technique | 1H–13C heteronuclear single quantum coherence |
Measurement Variables |
Data-Source Molecule ID | Data-Source |
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SCHEMBL20655542 | SureChEMBL |
137421318 | PubChem |
The data in this table is sourced from UniChem at EBI. |