CID 9715

2,4,6-tris(trifluoromethyl)-1,3,5-triazine

Structural Information

Molecular Formula

C₆F₉N₃

SMILES

C1(=NC(=NC(=N1)C(F)(F)F)C(F)(F)F)C(F)(F)F

InChI

InChI=1S/C6F9N3/c7-4(8,9)1-16-2(5(10,11)12)18-3(17-1)6(13,14)15

InChIKey

LSGBKABSSSIRJF-UHFFFAOYSA-N

Compound name

2,4,6-tris(trifluoromethyl)-1,3,5-triazine

Related CIDs

2D Structure

compound 2d structure

2
Annotation Hits: 2
References: 410
Patents: 284.99484 Da
Monoisotopic Mass: 2.7
XlogP (predicted)

Profile

Predicted Collision Cross Section

m/z: mass to charge ratio of the adduct.
Predicted Collision Cross Section (CCS) values (Å²) per adduct calculated using CCSbase.
Adduct	m/z	Predicted CCS (Å²)
[M+H]+	286.00212	171.8
[M+Na]+	307.98406	173.9
[M+NH4]+	303.02866	171.3
[M+K]+	323.95800	171.8
[M-H]-	283.98756	164.2
[M+Na-2H]-	305.96951	170.8
[M]+	284.99429	169.6
[M]-	284.99539	169.6

Literature stripe

literature stripe

Patent stripe

patents stripe