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

Formula: C20H17N3


Canonical SMILES:
c1ccc(nc1)c1ccc(cc1)C(c1[nH]ccc1)c1[nH]ccc1
InChI:
InChI=1S/C20H17N3/c1-2-12-21-17(5-1)15-8-10-16(11-9-15)20(18-6-3-13-22-18)19-7-4-14-23-19/h1-14,20,22-23H
InChIKey:
ILSHJPHOTBMRGU-UHFFFAOYSA-N
Exact Mass:
Crosslinks:   


Published on 2025-01-21This work is licensed under a Creative Commons Attribution 4.0 International License.

 

mass spectrometry (MS) 
Author: Michael Rotter1

1. Karlsruhe Institute of Technology, Germany

Analysis DOI:
Analysis ID:
Content:   
MS (ESI), m/z (%): 298 (100) [M–H]-, 199 (1), 118 (12), 116 (2), 111 (2), 103 (2), 102 (33). HRMS (ESI) (C20H18N3-): calc.: 298.1349, found: 298.1333.
Datasets