CID 533460

791614-71-6

Structural Information

Molecular Formula
C4H9N
SMILES
CC1CCN1
InChI
InChI=1S/C4H9N/c1-4-2-3-5-4/h4-5H,2-3H2,1H3
InChIKey
DLBWPRNUXWYLRN-UHFFFAOYSA-N
Compound name
2-methylazetidine
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

1
References

1047
Patents

71.0735 Da
Monoisotopic Mass

0.4
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 72.080776 110.5
[M+Na]+ 94.062718 117.3
[M+NH4]+ 89.107323 115.7
[M+K]+ 110.03666 113.8
[M-H]- 70.066224 108.7
[M+Na-2H]- 92.048166 114.0
[M]+ 71.072951 109.6
[M]- 71.074049 109.6
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