CID 10678708

142356-62-5

Structural Information

Molecular Formula
C7H5F2N3
SMILES
C1=C2C(=CC(=C1F)F)N=C(N2)N
InChI
InChI=1S/C7H5F2N3/c8-3-1-5-6(2-4(3)9)12-7(10)11-5/h1-2H,(H3,10,11,12)
InChIKey
ARMZWEKTPLCJKD-UHFFFAOYSA-N
Compound name
5,6-difluoro-1H-benzimidazol-2-amine
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

76
Patents

169.04515 Da
Monoisotopic Mass

1.5
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 170.05243 127.7
[M+Na]+ 192.03437 140.1
[M-H]- 168.03787 126.6
[M+NH4]+ 187.07897 147.9
[M+K]+ 208.00831 135.3
[M+H-H2O]+ 152.04241 119.7
[M+HCOO]- 214.04335 149.3
[M+CH3COO]- 228.05900 141.4
[M+Na-2H]- 190.01982 134.3
[M]+ 169.04460 124.5
[M]- 169.04570 124.5
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

patents stripe