CID 75645

Cyclobutylamine

Structural Information

Molecular Formula
C4H9N
SMILES
C1CC(C1)N
InChI
InChI=1S/C4H9N/c5-4-2-1-3-4/h4H,1-3,5H2
InChIKey
KZZKOVLJUKWSKX-UHFFFAOYSA-N
Compound name
cyclobutanamine
Related CIDs

2D Structure

compound 2d structure
2
Annotation Hits

10
References

19654
Patents

71.0735 Da
Monoisotopic Mass

0.2
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 72.080776 110.5
[M+Na]+ 94.062718 116.1
[M-H]- 70.066224 113.8
[M+NH4]+ 89.107323 127.8
[M+K]+ 110.03666 119.0
[M+H-H2O]+ 54.070760 100.8
[M+HCOO]- 116.07170 133.6
[M+CH3COO]- 130.08735 167.0
[M+Na-2H]- 92.048166 117.7
[M]+ 71.072951 115.1
[M]- 71.074049 115.1
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