CID 55934

Benzimidazole, 5-ethyl-2-(trifluoromethyl)-

Structural Information

Molecular Formula
C10H9F3N2
SMILES
CCC1=CC2=C(C=C1)N=C(N2)C(F)(F)F
InChI
InChI=1S/C10H9F3N2/c1-2-6-3-4-7-8(5-6)15-9(14-7)10(11,12)13/h3-5H,2H2,1H3,(H,14,15)
InChIKey
DPMJZEGWBKIXDX-UHFFFAOYSA-N
Compound name
6-ethyl-2-(trifluoromethyl)-1H-benzimidazole
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

6
Patents

214.07178 Da
Monoisotopic Mass

3.2
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 215.07906 145.5
[M+Na]+ 237.06100 155.6
[M+NH4]+ 232.10560 151.2
[M+K]+ 253.03494 151.6
[M-H]- 213.06450 141.8
[M+Na-2H]- 235.04645 149.5
[M]+ 214.07123 145.6
[M]- 214.07233 145.6
m/z: mass to charge ratio of the adduct.
Predicted Collision Cross Section (CCS) values (Ų) per adduct calculated using CCSbase.

Literature stripe

No literature data available for this compound.

Patent stripe

patents stripe