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

Formula: C17H20F2N6


Canonical SMILES:
CC(N(C(C)C)/N=N/c1n(ncc1C#N)Cc1cc(F)cc(c1)F)C
InChI:
InChI=1S/C17H20F2N6/c1-11(2)25(12(3)4)23-22-17-14(8-20)9-21-24(17)10-13-5-15(18)7-16(19)6-13/h5-7,9,11-12H,10H2,1-4H3/b23-22+
InChIKey:
ZFEWCQZPKGQXCJ-GHVJWSGMSA-N
Exact Mass:
Crosslinks:   


Published on 2021-07-11This work is licensed under a Creative Commons Attribution-ShareAlike 4.0 International License.

 

electron ionisation mass spectrometry (EI-MS) 
Author: Nicolai Wippert1

1. Institute of Organic Chemistry, Karlsruhe Institute of Technology, Germany

Analysis DOI:
Analysis ID:
Content:   
EI (m/z, 70 eV, 80 °C): 347 (10) [M+H]+, 346 (52) [M]+, 246 (29), 181 (19), 131 (29), 127 (51), 119 (10), 100 (33), 69 (100), 58 (22). HRMS (C17H20N6F2): calcd 346.1718, found 346.1716.
Datasets