CID 83678914

4-azaspiro[2.3]hexane

Structural Information

Molecular Formula
C5H9N
SMILES
C1CC12CCN2
InChI
InChI=1S/C5H9N/c1-2-5(1)3-4-6-5/h6H,1-4H2
InChIKey
RBWVZFZPIWEEHW-UHFFFAOYSA-N
Compound name
4-azaspiro[2.3]hexane
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

38
Patents

83.0735 Da
Monoisotopic Mass

0.3
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 84.080776 116.6
[M+Na]+ 106.06272 125.0
[M-H]- 82.066224 120.9
[M+NH4]+ 101.10732 129.8
[M+K]+ 122.03666 126.4
[M+H-H2O]+ 66.070760 107.3
[M+HCOO]- 128.07170 136.7
[M+CH3COO]- 142.08735 167.6
[M+Na-2H]- 104.04817 126.1
[M]+ 83.072951 123.6
[M]- 83.074049 123.6
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

patents stripe