CID 2737193

1235439-79-8

Structural Information

Molecular Formula
C11H14N4
SMILES
C1CN(CCN1)C2=NC3=CC=CC=C3N2
InChI
InChI=1S/C11H14N4/c1-2-4-10-9(3-1)13-11(14-10)15-7-5-12-6-8-15/h1-4,12H,5-8H2,(H,13,14)
InChIKey
NZXGDKLTTHIYTB-UHFFFAOYSA-N
Compound name
2-piperazin-1-yl-1H-benzimidazole
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

5
References

230
Patents

202.12184 Da
Monoisotopic Mass

1.1
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 203.12912 145.3
[M+Na]+ 225.11106 158.3
[M+NH4]+ 220.15566 153.2
[M+K]+ 241.08500 153.3
[M-H]- 201.11456 146.9
[M+Na-2H]- 223.09651 152.2
[M]+ 202.12129 147.4
[M]- 202.12239 147.4
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