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

Formula: C20H18INO2


Canonical SMILES:
COc1ccc(cc1)N(c1ccc(cc1)OC)c1ccc(cc1)I
InChI:
InChI=1S/C20H18INO2/c1-23-19-11-7-17(8-12-19)22(16-5-3-15(21)4-6-16)18-9-13-20(24-2)14-10-18/h3-14H,1-2H3
InChIKey:
VGQDQJMYUYSINZ-UHFFFAOYSA-N
Exact Mass:
Crosslinks:   


Published on 2025-02-26This work is licensed under a Creative Commons Attribution 4.0 International License.

 

electron ionisation mass spectrometry (EI-MS) 
Author: Henrik Tappert1

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

Analysis DOI:
Analysis ID:
Content:   
MS (EI, 70 eV, 100 °C), m/z (%): 431 (100) [M]+, 416 (42). HRMS (EI): m/z = calcd for C20H18O2N127I [M]+: 431.0377; found 431.0375.
Datasets