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

Formula: C17H22N6


Canonical SMILES:
CC(N(C(C)C)/N=N/c1n(ncc1C#N)Cc1ccccc1)C
InChI:
InChI=1S/C17H22N6/c1-13(2)23(14(3)4)21-20-17-16(10-18)11-19-22(17)12-15-8-6-5-7-9-15/h5-9,11,13-14H,12H2,1-4H3/b21-20+
InChIKey:
AQYSAXXLCHFEGV-QZQOTICOSA-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, 70 °C): 311 (10) [M+H]+, 310 (55) [M]+, 210 (26), 181 (20), 131 (30), 119 (12), 100 (42), 91 (78), 69 (100), 58 (21). HRMS (C17H22N6): calcd 310.1906, found 310.1905.
Datasets