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

Formula: C11H10N2O


Canonical SMILES:
N#CCCn1ccc2c1cc(O)cc2
InChI:
InChI=1S/C11H10N2O/c12-5-1-6-13-7-4-9-2-3-10(14)8-11(9)13/h2-4,7-8,14H,1,6H2
InChIKey:
PQNNNQZTTCGUHF-UHFFFAOYSA-N
Exact Mass:
Crosslinks:   


Published on 2023-07-31No License

 

mass spectrometry (MS) 
Author: Niklas Krappel1

1. IBCS-FMS, Karlsruhe Institute of Technology, Germany

Analysis DOI:
Analysis ID:
Content:   
MS (EI, 70 eV, 70 °C), m/z (%): 186 (66) [M]+, 146 (100) [M - CH2CN]+, 133 (19) [M - CH2CH2CN + H]+, 117 (11), 77 (10). HRMS–EI (C11H10ON2) (m/z): [M]+ calcd 186.0788; found 186.0786.
Datasets