CID 10422

Azetidine

Structural Information

Molecular Formula
C3H7N
SMILES
C1CNC1
InChI
InChI=1S/C3H7N/c1-2-4-3-1/h4H,1-3H2
InChIKey
HONIICLYMWZJFZ-UHFFFAOYSA-N
Compound name
azetidine
Related CIDs

2D Structure

compound 2d structure
2
Annotation Hits

224
References

155624
Patents

57.05785 Da
Monoisotopic Mass

-0.1
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 58.065126 105.9
[M+Na]+ 80.047068 111.6
[M-H]- 56.050574 106.6
[M+NH4]+ 75.091673 122.1
[M+K]+ 96.021008 114.2
[M+H-H2O]+ 40.055110 96.1
[M+HCOO]- 102.05605 126.3
[M+CH3COO]- 116.07170 159.2
[M+Na-2H]- 78.032516 114.8
[M]+ 57.057301 110.2
[M]- 57.058399 110.2
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