PubChemLite - Raf265 (C24H16F6N6O)

Structural Information

Molecular Formula

SMILES

CN1C2=C(C=C(C=C2)OC3=CC(=NC=C3)C4=NC=C(N4)C(F)(F)F)N=C1NC5=CC=C(C=C5)C(F)(F)F

InChI

InChI=1S/C24H16F6N6O/c1-36-19-7-6-15(10-17(19)34-22(36)33-14-4-2-13(3-5-14)23(25,26)27)37-16-8-9-31-18(11-16)21-32-12-20(35-21)24(28,29)30/h2-12H,1H3,(H,32,35)(H,33,34)

InChIKey

YABJJWZLRMPFSI-UHFFFAOYSA-N

Compound name

1-methyl-5-[2-[5-(trifluoromethyl)-1H-imidazol-2-yl]pyridin-4-yl]oxy-N-[4-(trifluoromethyl)phenyl]benzimidazol-2-amine

Related CIDs

2D Structure

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]+	519.13625	198.7
[M+Na]+	541.11819	205.3
[M+NH4]+	536.16279	199.0
[M+K]+	557.09213	204.0
[M-H]-	517.12169	195.0
[M+Na-2H]-	539.10364	202.3
[M]+	518.12842	198.2
[M]-	518.12952	198.2

Adduct

m/z

Predicted CCS (Å²)

[M+H]+

519.13625

198.7

[M+Na]+

541.11819

205.3

[M+NH4]+

536.16279

199.0

[M+K]+

557.09213

204.0

[M-H]-

517.12169

195.0

[M+Na-2H]-

539.10364

202.3

[M]+

518.12842

198.2

[M]-

518.12952

198.2

m/z: mass to charge ratio of the adduct.
Predicted Collision Cross Section (CCS) values (Å²) per adduct calculated using CCSbase.

Raf265

Structural Information

2D Structure

Profile

Predicted Collision Cross Section

Literature stripe

Patent stripe