CID 62415731

N-[(1-methyl-1h-imidazol-2-yl)methyl]cyclobutanamine

Structural Information

Molecular Formula
C9H15N3
SMILES
CN1C=CN=C1CNC2CCC2
InChI
InChI=1S/C9H15N3/c1-12-6-5-10-9(12)7-11-8-3-2-4-8/h5-6,8,11H,2-4,7H2,1H3
InChIKey
KCLRYVHEQBFJIM-UHFFFAOYSA-N
Compound name
N-[(1-methylimidazol-2-yl)methyl]cyclobutanamine
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

165.1266 Da
Monoisotopic Mass

0.3
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 166.133876 133.8
[M+Na]+ 188.115818 139.4
[M-H]- 164.119324 137.5
[M+NH4]+ 183.160423 146.8
[M+K]+ 204.089758 140.5
[M+H-H2O]+ 148.123860 120.9
[M+HCOO]- 210.124801 155.7
[M+CH3COO]- 224.140451 184.2
[M+Na-2H]- 186.101266 138.8
[M]+ 165.12605142 140.8
[M]- 165.12714858 140.8
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.