CID 149729428

2470436-48-5

Structural Information

Molecular Formula
C5H7NO3
SMILES
C1C(=O)CC1(C(=O)O)N
InChI
InChI=1S/C5H7NO3/c6-5(4(8)9)1-3(7)2-5/h1-2,6H2,(H,8,9)
InChIKey
AYWACIBPTGPWIN-UHFFFAOYSA-N
Compound name
1-amino-3-oxocyclobutane-1-carboxylic acid
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

2
Patents

129.04259 Da
Monoisotopic Mass

-4.1
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 130.04987 128.6
[M+Na]+ 152.03181 132.6
[M+NH4]+ 147.07641 132.7
[M+K]+ 168.00575 129.7
[M-H]- 128.03531 125.3
[M+Na-2H]- 150.01726 130.3
[M]+ 129.04204 126.7
[M]- 129.04314 126.7
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