This information is based on the molecular structure shown on the left side. For a decoupled sample, please refer to its individual details.

Formula: C11H13NO


Canonical SMILES:
CCCOc1ccc2c(c1)[nH]cc2
InChI:
InChI=1S/C11H13NO/c1-2-7-13-10-4-3-9-5-6-12-11(9)8-10/h3-6,8,12H,2,7H2,1H3
InChIKey:
JDVBDXYYRDRFRP-UHFFFAOYSA-N
Exact Mass:
Crosslinks:   


Published on 2023-07-31No License

 

1H nuclear magnetic resonance spectroscopy (1H NMR) 
Author: Niklas Krappel1

1. IBCS-FMS, Karlsruhe Institute of Technology, Germany

Analysis DOI:
Analysis ID:
Content:   
1H NMR (400 MHz, Chloroform-d [7.27 ppm], ppm) δ = 7.99 (bs, 1H), 7.51 (d, J = 8.6 Hz, 1H), 7.10 (dd, J = 3.3 Hz, J = 2.3 Hz, 1H), 6.89 (s, 1H), 6.81 (dd, J = 2.2 Hz, J = 8.6 Hz, 1H), 6.49 (m, 1H), 3.97 (d, J = 6.6 Hz, 2H), 1.85 (h, J = 7.3 Hz, 2H), 1.02 (t, J = 7.4 Hz, 3H). Impurities: Water (1.55), silicone grease (0.09).
Datasets