CID 53536965

1183150-96-0

Structural Information

Molecular Formula
C15H14FN3
SMILES
CC1=C(C=C(C=C1)C2=NC3=C(N2C)C=CC(=C3)F)N
InChI
InChI=1S/C15H14FN3/c1-9-3-4-10(7-12(9)17)15-18-13-8-11(16)5-6-14(13)19(15)2/h3-8H,17H2,1-2H3
InChIKey
UADBSPMSBXBNFZ-UHFFFAOYSA-N
Compound name
5-(5-fluoro-1-methylbenzimidazol-2-yl)-2-methylaniline
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

255.11717 Da
Monoisotopic Mass

2.9
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 256.124446 157.2
[M+Na]+ 278.106388 169.8
[M-H]- 254.109894 162.2
[M+NH4]+ 273.150993 174.8
[M+K]+ 294.080328 163.4
[M+H-H2O]+ 238.114430 148.2
[M+HCOO]- 300.115371 180.0
[M+CH3COO]- 314.131021 170.4
[M+Na-2H]- 276.091836 161.2
[M]+ 255.11662142 158.1
[M]- 255.11771858 158.1
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.