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

Formula: C10H5F3N2O3


Canonical SMILES:
OC(=O)c1ccc2c(c1)nc(c(=O)[nH]2)C(F)(F)F
InChI:
InChI=1S/C10H5F3N2O3/c11-10(12,13)7-8(16)15-5-2-1-4(9(17)18)3-6(5)14-7/h1-3H,(H,15,16)(H,17,18)
InChIKey:
QCOIWEBIQVDGKJ-UHFFFAOYSA-N
Exact Mass:
Crosslinks:   


Published on 2025-03-14This work is licensed under a Creative Commons Attribution 4.0 International License.

 

mass spectrometry (MS) 
Authors: Kameswara Sishta1 - Laura Holzhauer1

1. Institute of Biological and Chemical Systems - Functional Molecular Systems (IBCS-FMS), Karlsruhe Institute of Technology, Germany

Analysis DOI:
Analysis ID:
Content:   
MS (EI, 70 eV, 140 °C), m/z (%): 258 (100), 213 (63), 185 (21), 69 (17). HRMS (C10H5O3N2F3): calcd 258.0247, found 258.0245.
Datasets