Dataset
1H--13C heteronuclear single quantum coherence (1H-13C HSQC)
Chemical Info
InChI | InChI=1S/C17H17NO/c19-12-18-17-11-15-6-5-13-1-3-14(4-2-13)7-9-16(17)10-8-15/h1-4,8,10-12H,5-7,9H2,(H,18,19) |
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SMILES | O=CNc1cc2CCc3ccc(CCc1cc2)cc3 |
InChI Key | LCXUHIRWDWPRKN-UHFFFAOYSA-N |
Molecular Formula | C17H17NO |
Exact Mass | 251.323 g/mol |
Data and Resources
Metadata Information
Field | Value |
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DOI | 10.14272/LCXUHIRWDWPRKN-UHFFFAOYSA-N/CHMO0001146 |
License URL | |
Source | https://www.chemotion-repository.net/inchikey/LCXUHIRWDWPRKN-UHFFFAOYSA-N/CHMO0001146 |
Version | |
Author | Mareen Stahlberger |
Maintainer | Chemotion Repository |
Language | english |
MetadataCreated | 2024-09-07T07:00:35.277309 |
MetadataModified | 2024-09-07T22:33:39.134042 |
MetadataPublished | 2022-07-25 |
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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164889662 | PubChem |
The data in this table is sourced from UniChem at EBI. |