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

Formula: C16H27NO2S


Canonical SMILES:
C#CCNC(=O)CCCCCCCCCCSC(=O)C
InChI:
InChI=1S/C16H27NO2S/c1-3-13-17-16(19)12-10-8-6-4-5-7-9-11-14-20-15(2)18/h1H,4-14H2,2H3,(H,17,19)
InChIKey:
ZYZROVWSIIWVJU-UHFFFAOYSA-N
Exact Mass:
Crosslinks:   


Published on 2014-05-27This work is licensed under a Creative Commons Attribution-ShareAlike 4.0 International License.

 

1H nuclear magnetic resonance spectroscopy (1H NMR) 
Author: Sylvain Grosjean
Analysis DOI:
Analysis ID:
Content:   
1H-NMR (CDCl3, 300 MHz): δ = 5.73(b-s, 1H), 4.04 (dd, 2H, J = 5.1 Hz, J = 2.7 Hz), 2.85 (t, 2H, J = 7.2 Hz), 2.31 (s, 3H), 2.22 (t, 1H, J = 2.7 Hz), 2.18 (t, 2H, J = 7.2 Hz), 1.64-1.50 (m, 4H), 1.26(b-s, 12H) ppm.
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