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This information is based on the molecular structure shown on the left side. For a decoupled sample, please refer to its individual details.
Formula: C18H16O3
Canonical SMILES: CCC(c1c(=O)oc2c(c1O)cccc2)c1ccccc1
InChI: InChI=1S/C18H16O3/c1-2-13(12-8-4-3-5-9-12)16-17(19)14-10-6-7-11-15(14)21-18(16)20/h3-11,13,19H,2H2,1H3
InChIKey: DQDAYGNAKTZFIW-UHFFFAOYSA-N
Exact Mass:
Crosslinks: 
Published on 2025-01-30
heteronuclear multiple bond coherence (HMBC)
Author: 
Simone Gräßle1,2
1. Institute of Organic Chemistry, Karlsruhe Institute of Technology, Germany
2. Institute of Biological and Chemical Systems - Functional Molecular Systems, Karlsruhe Institute of Technology, Germany
Analysis DOI:
Analysis ID:
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