CID 3145400

64137-52-6

Structural Information

Molecular Formula
C11H15N3
SMILES
CNCCCC1=NC2=CC=CC=C2N1
InChI
InChI=1S/C11H15N3/c1-12-8-4-7-11-13-9-5-2-3-6-10(9)14-11/h2-3,5-6,12H,4,7-8H2,1H3,(H,13,14)
InChIKey
VMZCBGQDEWCDBV-UHFFFAOYSA-N
Compound name
3-(1H-benzimidazol-2-yl)-N-methylpropan-1-amine
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

74
Patents

189.1266 Da
Monoisotopic Mass

1.5
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 190.13388 141.1
[M+Na]+ 212.11582 153.6
[M+NH4]+ 207.16042 149.5
[M+K]+ 228.08976 148.0
[M-H]- 188.11932 142.9
[M+Na-2H]- 210.10127 147.8
[M]+ 189.12605 143.2
[M]- 189.12715 143.2
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