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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: C12H17ClO2
Canonical SMILES: COCOc1cc(C(C)C)c(cc1C)Cl
InChI: InChI=1S/C12H17ClO2/c1-8(2)10-6-12(15-7-14-4)9(3)5-11(10)13/h5-6,8H,7H2,1-4H3
InChIKey: LRPMRIMIWRGLKI-UHFFFAOYSA-N
Exact Mass:
Crosslinks: 
Published on 2021-11-03
distortionless enhancement with polarization transfer (DEPT)
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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