CID 339217

Brn 3617831

Structural Information

Molecular Formula
C10H8F3N3O
SMILES
C1=CC=C2C(=C1)NC(=N2)CNC(=O)C(F)(F)F
InChI
InChI=1S/C10H8F3N3O/c11-10(12,13)9(17)14-5-8-15-6-3-1-2-4-7(6)16-8/h1-4H,5H2,(H,14,17)(H,15,16)
InChIKey
TYVQPQCHMAWQMC-UHFFFAOYSA-N
Compound name
N-(1H-benzimidazol-2-ylmethyl)-2,2,2-trifluoroacetamide
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

243.06195 Da
Monoisotopic Mass

2.0
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 244.06923 147.9
[M+Na]+ 266.05117 155.8
[M+NH4]+ 261.09577 152.3
[M+K]+ 282.02511 153.4
[M-H]- 242.05467 143.5
[M+Na-2H]- 264.03662 151.3
[M]+ 243.06140 147.2
[M]- 243.06250 147.2
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

No patent data available for this compound.