CID 54901823

1178416-39-1

Structural Information

Molecular Formula
C14H19N3
SMILES
C1CCC(CC1)C(C2=NC3=CC=CC=C3N2)N
InChI
InChI=1S/C14H19N3/c15-13(10-6-2-1-3-7-10)14-16-11-8-4-5-9-12(11)17-14/h4-5,8-10,13H,1-3,6-7,15H2,(H,16,17)
InChIKey
VUYWMOWHCWXKHG-UHFFFAOYSA-N
Compound name
1H-benzimidazol-2-yl(cyclohexyl)methanamine
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

229.1579 Da
Monoisotopic Mass

2.8
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 230.165176 151.9
[M+Na]+ 252.147118 157.2
[M-H]- 228.150624 154.3
[M+NH4]+ 247.191723 168.3
[M+K]+ 268.121058 151.9
[M+H-H2O]+ 212.155160 143.3
[M+HCOO]- 274.156101 169.3
[M+CH3COO]- 288.171751 162.2
[M+Na-2H]- 250.132566 155.5
[M]+ 229.15735142 145.0
[M]- 229.15844858 145.0
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.