CID 145874396

2375267-63-1

Structural Information

Molecular Formula
C10H6F6N2O
SMILES
C1=CC=C2C(=C1)N=CN2C(C(OC(F)(F)F)F)(F)F
InChI
InChI=1S/C10H6F6N2O/c11-8(19-10(14,15)16)9(12,13)18-5-17-6-3-1-2-4-7(6)18/h1-5,8H
InChIKey
UFHTWBBBRNBAFO-UHFFFAOYSA-N
Compound name
1-[1,1,2-trifluoro-2-(trifluoromethoxy)ethyl]benzimidazole
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

284.03842 Da
Monoisotopic Mass

3.7
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 285.04570 153.4
[M+Na]+ 307.02764 164.4
[M-H]- 283.03114 148.4
[M+NH4]+ 302.07224 169.2
[M+K]+ 323.00158 160.4
[M+H-H2O]+ 267.03568 141.7
[M+HCOO]- 329.03662 166.5
[M+CH3COO]- 343.05227 197.8
[M+Na-2H]- 305.01309 158.7
[M]+ 284.03787 148.6
[M]- 284.03897 148.6
m/z: mass to charge ratio of the adduct.
Predicted Collision Cross Section (CCS) values (Ų) per adduct calculated using CCSbase.

Literature stripe

literature stripe

Patent stripe

No patent data available for this compound.