CID 46310294

1-[1-methyl-5-(trifluoromethyl)-1h-1,3-benzodiazol-2-yl]ethan-1-ol

Structural Information

Molecular Formula
C11H11F3N2O
SMILES
CC(C1=NC2=C(N1C)C=CC(=C2)C(F)(F)F)O
InChI
InChI=1S/C11H11F3N2O/c1-6(17)10-15-8-5-7(11(12,13)14)3-4-9(8)16(10)2/h3-6,17H,1-2H3
InChIKey
BRURGSKWINBYTO-UHFFFAOYSA-N
Compound name
1-[1-methyl-5-(trifluoromethyl)benzimidazol-2-yl]ethanol
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

244.08235 Da
Monoisotopic Mass

1.9
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 245.08963 153.6
[M+Na]+ 267.07157 163.1
[M+NH4]+ 262.11617 158.5
[M+K]+ 283.04551 160.3
[M-H]- 243.07507 149.2
[M+Na-2H]- 265.05702 156.3
[M]+ 244.08180 153.4
[M]- 244.08290 153.4
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.