CID 21830191

N-methylcyclobutanamine

Structural Information

Molecular Formula
C5H11N
SMILES
CNC1CCC1
InChI
InChI=1S/C5H11N/c1-6-5-3-2-4-5/h5-6H,2-4H2,1H3
InChIKey
JSIGUUUNVYUWQT-UHFFFAOYSA-N
Compound name
N-methylcyclobutanamine
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

2279
Patents

85.08915 Da
Monoisotopic Mass

0.7
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 86.096426 114.3
[M+Na]+ 108.07837 119.4
[M-H]- 84.081874 117.9
[M+NH4]+ 103.12297 131.3
[M+K]+ 124.05231 122.4
[M+H-H2O]+ 68.086410 104.4
[M+HCOO]- 130.08735 137.7
[M+CH3COO]- 144.10300 170.7
[M+Na-2H]- 106.06382 122.0
[M]+ 85.088601 120.2
[M]- 85.089699 120.2
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