CID 6510100

Brn 4443367

Structural Information

Molecular Formula
C13H16N4
SMILES
CN\1CCCC/C1=N/C2=NC3=CC=CC=C3N2
InChI
InChI=1S/C13H16N4/c1-17-9-5-4-8-12(17)16-13-14-10-6-2-3-7-11(10)15-13/h2-3,6-7H,4-5,8-9H2,1H3,(H,14,15)/b16-12-
InChIKey
NZWYJSGKRYQFBG-VBKFSLOCSA-N
Compound name
(Z)-N-(1H-benzimidazol-2-yl)-1-methylpiperidin-2-imine
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

228.1375 Da
Monoisotopic Mass

1.9
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 229.14478 151.9
[M+Na]+ 251.12672 165.0
[M+NH4]+ 246.17132 160.3
[M+K]+ 267.10066 159.2
[M-H]- 227.13022 155.4
[M+Na-2H]- 249.11217 159.3
[M]+ 228.13695 154.6
[M]- 228.13805 154.6
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.