CID 119086753

1467571-05-6

Structural Information

Molecular Formula
C9H10ClN3
SMILES
CN(C)C1=CC2=C(C=C1)N=C(N2)Cl
InChI
InChI=1S/C9H10ClN3/c1-13(2)6-3-4-7-8(5-6)12-9(10)11-7/h3-5H,1-2H3,(H,11,12)
InChIKey
MMQJJKHJWIUMGY-UHFFFAOYSA-N
Compound name
2-chloro-N,N-dimethyl-3H-benzimidazol-5-amine
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

195.05632 Da
Monoisotopic Mass

2.7
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 196.063596 138.9
[M+Na]+ 218.045538 150.2
[M-H]- 194.049044 141.5
[M+NH4]+ 213.090143 159.6
[M+K]+ 234.019478 145.8
[M+H-H2O]+ 178.053580 132.3
[M+HCOO]- 240.054521 158.3
[M+CH3COO]- 254.070171 152.8
[M+Na-2H]- 216.030986 145.9
[M]+ 195.05577142 142.2
[M]- 195.05686858 142.2
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.