CID 66833956

Oxetane-3-carboxamide

Structural Information

Molecular Formula
C4H7NO2
SMILES
C1C(CO1)C(=O)N
InChI
InChI=1S/C4H7NO2/c5-4(6)3-1-7-2-3/h3H,1-2H2,(H2,5,6)
InChIKey
NJYYWQHQUOODDL-UHFFFAOYSA-N
Compound name
oxetane-3-carboxamide
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

416
Patents

101.047676 Da
Monoisotopic Mass

-1.3
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 102.05495 115.7
[M+Na]+ 124.03689 120.9
[M-H]- 100.04040 119.4
[M+NH4]+ 119.08150 130.2
[M+K]+ 140.01083 125.5
[M+H-H2O]+ 84.044936 105.3
[M+HCOO]- 146.04588 137.4
[M+CH3COO]- 160.06153 170.8
[M+Na-2H]- 122.02234 122.4
[M]+ 101.04713 122.2
[M]- 101.04822 122.2
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